N-benzhydryl-2-methylpiperidine-1-carboxamide

C20H24N2O — CID 108867475

IUPACN-benzhydryl-2-methylpiperidine-1-carboxamide
SMILESCC1CCCCN1C(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H24N2O/c1-16-10-8-9-15-22(16)20(23)21-19(17-11-4-2-5-12-17)18-13-6-3-7-14-18/h2-7,11-14,16,19H,8-10,15H2,1H3,(H,21,23)
InChIKeyCMXQOHWRUWIUCD-UHFFFAOYSA-N
MW308.43 g/mol
LogP4.36
Rot. Bonds3

About N-benzhydryl-2-methylpiperidine-1-carboxamide

N-benzhydryl-2-methylpiperidine-1-carboxamide (PubChem CID 108867475) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is N-benzhydryl-2-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-benzhydryl-2-methylpiperidine-1-carboxamide
PubChem CID108867475
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC NameN-benzhydryl-2-methylpiperidine-1-carboxamide
SMILESCC1CCCCN1C(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H24N2O/c1-16-10-8-9-15-22(16)20(23)21-19(17-11-4-2-5-12-17)18-13-6-3-7-14-18/h2-7,11-14,16,19H,8-10,15H2,1H3,(H,21,23)
InChIKeyCMXQOHWRUWIUCD-UHFFFAOYSA-N
XLogP4.36
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-amino-1-(2-methylpiperidin-1-yl)-2-phenylethanone
CID 24694891
(2R)-2-(2-chlorophenyl)-2-[(2-methylpyrrolidine-1-carbonyl)amino]acetic acid
CID 107316001
2-methyl-N-(4-phenylphenyl)piperidine-1-carboxamide
CID 23823514
2-methyl-N-[5-oxo-1-(1-phenylethyl)pyrrolidin-3-yl]piperidine-1-carboxamide
CID 108875809
2-methyl-N-(2-methylphenyl)piperidine-1-carboxamide
CID 6460442
N-benzhydryl-2-(2,6-dimethylpiperidin-1-yl)acetamide
CID 117068368
N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]propanamide
CID 134270184
(2S)-2-[[(2S)-1-[(2S)-2-methylpiperidin-1-yl]-1-oxopropan-2-yl]carbamoylamino]-2-phenylacetamide
CID 95338642
N-[1-(4-cyanophenyl)ethyl]-2-methylpiperidine-1-carboxamide
CID 47254048
N-[(2S)-1-[(2R)-2-methylpiperidin-1-yl]-1-oxopropan-2-yl]-1,3-dihydroisoindole-2-carboxamide
CID 95612434
N-butan-2-yl-2-methylpiperidine-1-carboxamide
CID 45366573
(2S)-3,3-dimethyl-2-[(2-methylpiperidine-1-carbonyl)amino]butanoic acid
CID 61188083

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-2-methylpiperidine-1-carboxamide?
The IUPAC name of N-benzhydryl-2-methylpiperidine-1-carboxamide (CID 108867475) is N-benzhydryl-2-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-benzhydryl-2-methylpiperidine-1-carboxamide?
The canonical SMILES for N-benzhydryl-2-methylpiperidine-1-carboxamide is CC1CCCCN1C(=O)NC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-benzhydryl-2-methylpiperidine-1-carboxamide?
The InChIKey is CMXQOHWRUWIUCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c1-16-10-8-9-15-22(16)20(23)21-19(17-11-4-2-5-12-17)18-13-6-3-7-14-18/h2-7,11-14,16,19H,8-10,15H2,1H3,(H,21,23).
What are the key properties of N-benzhydryl-2-methylpiperidine-1-carboxamide?
N-benzhydryl-2-methylpiperidine-1-carboxamide has a molecular weight of 308.43 g/mol, XLogP of 4.36, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-2-methylpiperidine-1-carboxamide is sourced from PubChem (CID 108867475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).