2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide

C19H21ClN2O — CID 46891489

IUPAC2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide
SMILESO=C(NCC1CCNCC1)c1ccccc1-c1ccc(Cl)cc1
InChIInChI=1S/C19H21ClN2O/c20-16-7-5-15(6-8-16)17-3-1-2-4-18(17)19(23)22-13-14-9-11-21-12-10-14/h1-8,14,21H,9-13H2,(H,22,23)
InChIKeyRLBJMUXKFVXYFZ-UHFFFAOYSA-N
MW328.84 g/mol
LogP3.74
Rot. Bonds4

About 2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide

2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide (PubChem CID 46891489) has the molecular formula C19H21ClN2O and a molecular weight of 328.84 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide
PubChem CID46891489
Molecular FormulaC19H21ClN2O
Molecular Weight328.84 g/mol
Exact Mass328.13
IUPAC Name2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide
SMILESO=C(NCC1CCNCC1)c1ccccc1-c1ccc(Cl)cc1
InChIInChI=1S/C19H21ClN2O/c20-16-7-5-15(6-8-16)17-3-1-2-4-18(17)19(23)22-13-14-9-11-21-12-10-14/h1-8,14,21H,9-13H2,(H,22,23)
InChIKeyRLBJMUXKFVXYFZ-UHFFFAOYSA-N
XLogP3.74
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.84
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide 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 2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide (CID 46891489) is 2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide is O=C(NCC1CCNCC1)c1ccccc1-c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide?
The InChIKey is RLBJMUXKFVXYFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O/c20-16-7-5-15(6-8-16)17-3-1-2-4-18(17)19(23)22-13-14-9-11-21-12-10-14/h1-8,14,21H,9-13H2,(H,22,23).
What are the key properties of 2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide?
2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide has a molecular weight of 328.84 g/mol, XLogP of 3.74, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(piperidin-4-ylmethyl)benzamide is sourced from PubChem (CID 46891489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).