piperidin-4-yl N-benzhydrylcarbamate

C19H22N2O2 — CID 10638702

IUPACpiperidin-4-yl N-benzhydrylcarbamate
SMILESO=C(NC(c1ccccc1)c1ccccc1)OC1CCNCC1
InChIInChI=1S/C19H22N2O2/c22-19(23-17-11-13-20-14-12-17)21-18(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,17-18,20H,11-14H2,(H,21,22)
InChIKeyAYOUSUMYGDFOPL-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.25
Rot. Bonds4

About piperidin-4-yl N-benzhydrylcarbamate

piperidin-4-yl N-benzhydrylcarbamate (PubChem CID 10638702) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is piperidin-4-yl N-benzhydrylcarbamate.

Molecular Properties

Compound Namepiperidin-4-yl N-benzhydrylcarbamate
PubChem CID10638702
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Namepiperidin-4-yl N-benzhydrylcarbamate
SMILESO=C(NC(c1ccccc1)c1ccccc1)OC1CCNCC1
InChIInChI=1S/C19H22N2O2/c22-19(23-17-11-13-20-14-12-17)21-18(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,17-18,20H,11-14H2,(H,21,22)
InChIKeyAYOUSUMYGDFOPL-UHFFFAOYSA-N
XLogP3.25
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze piperidin-4-yl N-benzhydrylcarbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of piperidin-4-yl N-benzhydrylcarbamate?
The IUPAC name of piperidin-4-yl N-benzhydrylcarbamate (CID 10638702) is piperidin-4-yl N-benzhydrylcarbamate.
What is the SMILES notation for piperidin-4-yl N-benzhydrylcarbamate?
The canonical SMILES for piperidin-4-yl N-benzhydrylcarbamate is O=C(NC(c1ccccc1)c1ccccc1)OC1CCNCC1.
What is the InChIKey of piperidin-4-yl N-benzhydrylcarbamate?
The InChIKey is AYOUSUMYGDFOPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c22-19(23-17-11-13-20-14-12-17)21-18(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-10,17-18,20H,11-14H2,(H,21,22).
What are the key properties of piperidin-4-yl N-benzhydrylcarbamate?
piperidin-4-yl N-benzhydrylcarbamate has a molecular weight of 310.40 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-4-yl N-benzhydrylcarbamate is sourced from PubChem (CID 10638702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).