benzyl N-(piperidin-4-ylmethyl)carbamate

C14H20N2O2 — CID 14809798

IUPACbenzyl N-(piperidin-4-ylmethyl)carbamate
SMILESO=C(NCC1CCNCC1)OCc1ccccc1
InChIInChI=1S/C14H20N2O2/c17-14(16-10-12-6-8-15-9-7-12)18-11-13-4-2-1-3-5-13/h1-5,12,15H,6-11H2,(H,16,17)
InChIKeyBZHPVEHRXAKHMV-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.91
Rot. Bonds4

About benzyl N-(piperidin-4-ylmethyl)carbamate

benzyl N-(piperidin-4-ylmethyl)carbamate (PubChem CID 14809798) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is benzyl N-(piperidin-4-ylmethyl)carbamate.

Molecular Properties

Compound Namebenzyl N-(piperidin-4-ylmethyl)carbamate
PubChem CID14809798
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Namebenzyl N-(piperidin-4-ylmethyl)carbamate
SMILESO=C(NCC1CCNCC1)OCc1ccccc1
InChIInChI=1S/C14H20N2O2/c17-14(16-10-12-6-8-15-9-7-12)18-11-13-4-2-1-3-5-13/h1-5,12,15H,6-11H2,(H,16,17)
InChIKeyBZHPVEHRXAKHMV-UHFFFAOYSA-N
XLogP1.91
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze benzyl N-(piperidin-4-ylmethyl)carbamate 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 benzyl N-(piperidin-4-ylmethyl)carbamate?
The IUPAC name of benzyl N-(piperidin-4-ylmethyl)carbamate (CID 14809798) is benzyl N-(piperidin-4-ylmethyl)carbamate.
What is the SMILES notation for benzyl N-(piperidin-4-ylmethyl)carbamate?
The canonical SMILES for benzyl N-(piperidin-4-ylmethyl)carbamate is O=C(NCC1CCNCC1)OCc1ccccc1.
What is the InChIKey of benzyl N-(piperidin-4-ylmethyl)carbamate?
The InChIKey is BZHPVEHRXAKHMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c17-14(16-10-12-6-8-15-9-7-12)18-11-13-4-2-1-3-5-13/h1-5,12,15H,6-11H2,(H,16,17).
What are the key properties of benzyl N-(piperidin-4-ylmethyl)carbamate?
benzyl N-(piperidin-4-ylmethyl)carbamate has a molecular weight of 248.33 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-(piperidin-4-ylmethyl)carbamate is sourced from PubChem (CID 14809798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).