N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide

C22H32N2O2 — CID 55607775

IUPACN-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide
SMILESCN(C(=O)C1CCCN(C(=O)Cc2ccccc2)C1)C1CCCCCC1
InChIInChI=1S/C22H32N2O2/c1-23(20-13-7-2-3-8-14-20)22(26)19-12-9-15-24(17-19)21(25)16-18-10-5-4-6-11-18/h4-6,10-11,19-20H,2-3,7-9,12-17H2,1H3
InChIKeyYLIRDVFYZKPQPV-UHFFFAOYSA-N
MW356.51 g/mol
LogP3.65
Rot. Bonds4

About N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide

N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide (PubChem CID 55607775) has the molecular formula C22H32N2O2 and a molecular weight of 356.51 g/mol. Its IUPAC name is N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide
PubChem CID55607775
Molecular FormulaC22H32N2O2
Molecular Weight356.51 g/mol
Exact Mass356.25
IUPAC NameN-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide
SMILESCN(C(=O)C1CCCN(C(=O)Cc2ccccc2)C1)C1CCCCCC1
InChIInChI=1S/C22H32N2O2/c1-23(20-13-7-2-3-8-14-20)22(26)19-12-9-15-24(17-19)21(25)16-18-10-5-4-6-11-18/h4-6,10-11,19-20H,2-3,7-9,12-17H2,1H3
InChIKeyYLIRDVFYZKPQPV-UHFFFAOYSA-N
XLogP3.65
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.51
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-cycloheptyl-1-[2-(4-fluorophenyl)acetyl]-N-methylpiperidine-3-carboxamide
CID 55758241
N-[[4-(dimethylamino)phenyl]methyl]-N-ethyl-1-(2-phenylacetyl)piperidine-3-carboxamide
CID 55629106
(3S)-N-methyl-1-(2-phenylacetyl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 51939813
1-[(3S)-3-methylpiperidin-1-yl]-2-phenylethanone
CID 668860
N-methyl-1-(2-phenylacetyl)-N-(3-propan-2-ylphenyl)piperidine-3-carboxamide
CID 60586831
N-methyl-1-(3-phenoxypropanoyl)-N-piperidin-4-ylpiperidine-3-carboxamide
CID 119443941
(3S,4S)-4-methyl-1-[1-(2-phenylacetyl)piperidine-3-carbonyl]pyrrolidine-3-carboxylic acid
CID 120952273
1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide
CID 134025371
1-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-2-phenylethanone
CID 174895598
1-[3-(4-methylbenzoyl)piperidin-1-yl]-2-phenylethanone
CID 110394612
1-[2-(4-phenylphenyl)acetyl]piperidine-3-carboxylic acid
CID 45429214
(3R)-N-cyclopentyl-N-methyl-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide
CID 92680091

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide?
The IUPAC name of N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide (CID 55607775) is N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide.
What is the SMILES notation for N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide?
The canonical SMILES for N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide is CN(C(=O)C1CCCN(C(=O)Cc2ccccc2)C1)C1CCCCCC1.
What is the InChIKey of N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide?
The InChIKey is YLIRDVFYZKPQPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N2O2/c1-23(20-13-7-2-3-8-14-20)22(26)19-12-9-15-24(17-19)21(25)16-18-10-5-4-6-11-18/h4-6,10-11,19-20H,2-3,7-9,12-17H2,1H3.
What are the key properties of N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide?
N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide has a molecular weight of 356.51 g/mol, XLogP of 3.65, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide is sourced from PubChem (CID 55607775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).