1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide

C19H20Cl2N2O — CID 43925060

IUPAC1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C19H20Cl2N2O/c20-17-9-8-16(11-18(17)21)22-19(24)15-7-4-10-23(13-15)12-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,15H,4,7,10,12-13H2,(H,22,24)
InChIKeyCNWAKTILVDNPGX-UHFFFAOYSA-N
MW363.29 g/mol
LogP4.84
Rot. Bonds4

About 1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide

1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide (PubChem CID 43925060) has the molecular formula C19H20Cl2N2O and a molecular weight of 363.29 g/mol. Its IUPAC name is 1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide
PubChem CID43925060
Molecular FormulaC19H20Cl2N2O
Molecular Weight363.29 g/mol
Exact Mass362.10
IUPAC Name1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C19H20Cl2N2O/c20-17-9-8-16(11-18(17)21)22-19(24)15-7-4-10-23(13-15)12-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,15H,4,7,10,12-13H2,(H,22,24)
InChIKeyCNWAKTILVDNPGX-UHFFFAOYSA-N
XLogP4.84
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.29
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

1-[(2-chlorophenyl)methyl]-N-(3,4-dichlorophenyl)piperidine-3-carboxamide
CID 43925064
(3S)-1-benzyl-N-(3-chlorophenyl)piperidine-3-carboxamide
CID 93490524
(3R)-1-benzyl-N-(3-chlorophenyl)piperidine-3-carboxamide
CID 93490525
(3S)-1-benzyl-N-(3,4-dimethylphenyl)piperidine-3-carboxamide
CID 93490442
1-benzyl-N-[3-(phenylcarbamoylamino)phenyl]piperidine-3-carboxamide
CID 47074842
1-benzyl-N-(2-chlorophenyl)piperidine-3-carboxamide
CID 43919369
N-(3-chloro-4-fluorophenyl)-1-[(4-chlorophenyl)methyl]piperidine-3-carboxamide
CID 43923085
(3S)-1-benzyl-N-(4-phenoxyphenyl)piperidine-3-carboxamide
CID 93490714
1-benzyl-N-(4-phenoxyphenyl)piperidine-3-carboxamide
CID 43919796
N-(4-bromo-3-chlorophenyl)-1-[(4-chlorophenyl)methyl]piperidine-3-carboxamide
CID 43924875
1-[(3-bromophenyl)methyl]-N-(3-chloro-4-fluorophenyl)piperidine-3-carboxamide
CID 43923089
N-[4-(azepan-1-ylsulfonyl)phenyl]-1-[(3,4-dichlorophenyl)methyl]piperidine-3-carboxamide
CID 43925168

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide?
The IUPAC name of 1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide (CID 43925060) is 1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide?
The canonical SMILES for 1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide is O=C(Nc1ccc(Cl)c(Cl)c1)C1CCCN(Cc2ccccc2)C1.
What is the InChIKey of 1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide?
The InChIKey is CNWAKTILVDNPGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O/c20-17-9-8-16(11-18(17)21)22-19(24)15-7-4-10-23(13-15)12-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,15H,4,7,10,12-13H2,(H,22,24).
What are the key properties of 1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide?
1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide has a molecular weight of 363.29 g/mol, XLogP of 4.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide is sourced from PubChem (CID 43925060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).