1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide

C24H28N2O2 — CID 55622704

IUPAC1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide
SMILESCc1ccc(C(=O)N2CCCC(C(=O)NC3CCc4ccccc4C3)C2)cc1
InChIInChI=1S/C24H28N2O2/c1-17-8-10-19(11-9-17)24(28)26-14-4-7-21(16-26)23(27)25-22-13-12-18-5-2-3-6-20(18)15-22/h2-3,5-6,8-11,21-22H,4,7,12-16H2,1H3,(H,25,27)
InChIKeyZMIRHSQOJFXVAA-UHFFFAOYSA-N
MW376.50 g/mol
LogP3.52
Rot. Bonds3

About 1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide

1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide (PubChem CID 55622704) has the molecular formula C24H28N2O2 and a molecular weight of 376.50 g/mol. Its IUPAC name is 1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide
PubChem CID55622704
Molecular FormulaC24H28N2O2
Molecular Weight376.50 g/mol
Exact Mass376.22
IUPAC Name1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide
SMILESCc1ccc(C(=O)N2CCCC(C(=O)NC3CCc4ccccc4C3)C2)cc1
InChIInChI=1S/C24H28N2O2/c1-17-8-10-19(11-9-17)24(28)26-14-4-7-21(16-26)23(27)25-22-13-12-18-5-2-3-6-20(18)15-22/h2-3,5-6,8-11,21-22H,4,7,12-16H2,1H3,(H,25,27)
InChIKeyZMIRHSQOJFXVAA-UHFFFAOYSA-N
XLogP3.52
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-N-[(1R,1aR,7bR)-1a,2,3,7b-tetrahydro-1H-cyclopropa[a]naphthalen-1-yl]-1-(4-methylbenzoyl)piperidine-3-carboxamide
CID 100867602
tert-butyl 3-(1,2,3,4-tetrahydronaphthalen-2-ylcarbamoyl)piperidine-1-carboxylate
CID 55438903
N-(1-benzylpiperidin-4-yl)-1-(4-methylbenzoyl)piperidine-3-carboxamide
CID 46404586
methyl 2-[1-(4-methylbenzoyl)piperidine-3-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate
CID 78861318
2-[2-[[1-(4-methylbenzoyl)piperidine-3-carbonyl]amino]phenyl]acetic acid
CID 119218307
N-cycloheptyl-1-[4-[(4-methylphenyl)sulfonylamino]benzoyl]piperidine-3-carboxamide
CID 46384573
N-(3,4-dihydro-2H-chromen-4-yl)-1-(4-methylbenzoyl)piperidine-3-carboxamide
CID 46404128
1-benzoyl-N-(4-hydroxycyclohexyl)piperidine-3-carboxamide
CID 69258968
4-[(1-benzoylpiperidine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 119229696
(3S)-1-(4-methylbenzoyl)piperidine-3-carboxylic acid
CID 42257342
N-cyclohexyl-1-(3-methylbenzoyl)piperidine-3-carboxamide
CID 50803988
N-[1-(4-methylbenzoyl)piperidin-4-yl]cyclobutanecarboxamide
CID 110820327

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide?
The IUPAC name of 1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide (CID 55622704) is 1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide?
The canonical SMILES for 1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide is Cc1ccc(C(=O)N2CCCC(C(=O)NC3CCc4ccccc4C3)C2)cc1.
What is the InChIKey of 1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide?
The InChIKey is ZMIRHSQOJFXVAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O2/c1-17-8-10-19(11-9-17)24(28)26-14-4-7-21(16-26)23(27)25-22-13-12-18-5-2-3-6-20(18)15-22/h2-3,5-6,8-11,21-22H,4,7,12-16H2,1H3,(H,25,27).
What are the key properties of 1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide?
1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide has a molecular weight of 376.50 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylbenzoyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidine-3-carboxamide is sourced from PubChem (CID 55622704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).