N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide

C23H28N2O2 — CID 113008859

IUPACN-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide
SMILESCCN(C(=O)C1CCN(C(=O)c2ccccc2C)CC1)c1cccc(C)c1
InChIInChI=1S/C23H28N2O2/c1-4-25(20-10-7-8-17(2)16-20)22(26)19-12-14-24(15-13-19)23(27)21-11-6-5-9-18(21)3/h5-11,16,19H,4,12-15H2,1-3H3
InChIKeyUUMRCPWOXKDRIM-UHFFFAOYSA-N
MW364.49 g/mol
LogP4.21
Rot. Bonds4

About N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide

N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide (PubChem CID 113008859) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide
PubChem CID113008859
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC NameN-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide
SMILESCCN(C(=O)C1CCN(C(=O)c2ccccc2C)CC1)c1cccc(C)c1
InChIInChI=1S/C23H28N2O2/c1-4-25(20-10-7-8-17(2)16-20)22(26)19-12-14-24(15-13-19)23(27)21-11-6-5-9-18(21)3/h5-11,16,19H,4,12-15H2,1-3H3
InChIKeyUUMRCPWOXKDRIM-UHFFFAOYSA-N
XLogP4.21
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,2-dimethylpropanoyl)-N-ethyl-N-(3-methylphenyl)piperidine-4-carboxamide
CID 17224500
N-ethyl-N-(3-methylphenyl)cyclohexanecarboxamide
CID 533210
1-N-[2-(dimethylamino)ethyl]-4-N-ethyl-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109147165
N-ethyl-1-(1H-indole-3-carbonyl)-N-(3-methylphenyl)azetidine-3-carboxamide
CID 90511743
1-N-butan-2-yl-4-N-ethyl-4-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109145572
4-N-ethyl-4-N-(3-methylphenyl)-1-N-propan-2-ylcyclohexane-1,4-dicarboxamide
CID 109144641
3-[ethyl-(3-methylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63782796
4-N-ethyl-4-N-(3-methylphenyl)-1-N-(4-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109150509
N-ethyl-N-(3-methylphenyl)-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
CID 90511068
N-ethyl-1-(2-methylpropanoyl)-N-phenylpiperidine-4-carboxamide
CID 113006682
N-ethyl-N-(3-methylphenyl)thiane-3-carboxamide
CID 110865038
N-ethyl-N-(3-methylphenyl)-4-(piperidine-1-carbonyl)benzamide
CID 109044713

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide?
The IUPAC name of N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide (CID 113008859) is N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide.
What is the SMILES notation for N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide?
The canonical SMILES for N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide is CCN(C(=O)C1CCN(C(=O)c2ccccc2C)CC1)c1cccc(C)c1.
What is the InChIKey of N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide?
The InChIKey is UUMRCPWOXKDRIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O2/c1-4-25(20-10-7-8-17(2)16-20)22(26)19-12-14-24(15-13-19)23(27)21-11-6-5-9-18(21)3/h5-11,16,19H,4,12-15H2,1-3H3.
What are the key properties of N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide?
N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide has a molecular weight of 364.49 g/mol, XLogP of 4.21, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-methylbenzoyl)-N-(3-methylphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 113008859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).