Ethyl 4-Piperidinecarboxylate

Ethyl 4-Piperidinecarboxylate

Cat. No.: PI1126096

Ethyl 4-Piperidinecarboxylate
Product Details Other Identifiers Computed Properties
CAS 1126-09-6
Synonyms Ethyl piperidine-4-carboxylate
Purity 97%
Molecular Formula C8H15NO2
Molecular Weight 157.21
Molar Refractivity 46.46
Pubchem ID 70770
InChI Key RUJPPJYDHHAEEK-UHFFFAOYSA-N
MDL Number MFCD00006003
Aromatic Heavy Atoms Number 0
BBB Permeant No
Bioavailability Score 0.55
Brenk 0.0 alert
Consensus Log Po/w 0.95
CYP1A2Inhibitor No
CYP2C19Inhibitor No
CYP2C9Inhibitor No
CYP2D6Inhibitor No
CYP3A4Inhibitor No
Egan 0.0
Fraction Csp3 0.88
Ghose None
GI Absorption High
Heavy Atom Count 11
Hydrogen Bond Acceptor Count 3.0
Hydrogen Bond Donor Count 1.0
Leadlikeness 1.0
Lipinski 0.0
Log Kp (Skin Permeation) -6.9 cm/s
Log Po/w (iLOGP) 2.15
Log Po/w (MLOGP) 0.69
Log Po/w (SILICOS-IT) 1.22
Log Po/w (WLOGP) 0.17
Log Po/w (XLOGP3) 0.51
Muegge 1.0
PAINS 0.0 alert
P-gp Substrate No
Rotatable Bond Count 3
Synthetic Accessibility 1.42
Topological Polar Surface Area 38.33 Ų
Veber 0.0

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