N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide

C22H26N2O2 — CID 143430707

IUPACN-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1)C1CCC[C@@H](N(C)C(=O)c2ccccc2)C1
InChIInChI=1S/C22H26N2O2/c1-23(21(25)17-10-5-3-6-11-17)19-14-9-15-20(16-19)24(2)22(26)18-12-7-4-8-13-18/h3-8,10-13,19-20H,9,14-16H2,1-2H3/t19-,20?/m1/s1
InChIKeyRKUCRHDVEHIXGQ-FIWHBWSRSA-N
MW350.46 g/mol
LogP3.84
Rot. Bonds4

About N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide

N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide (PubChem CID 143430707) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide.

Molecular Properties

Compound NameN-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide
PubChem CID143430707
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1)C1CCC[C@@H](N(C)C(=O)c2ccccc2)C1
InChIInChI=1S/C22H26N2O2/c1-23(21(25)17-10-5-3-6-11-17)19-14-9-15-20(16-19)24(2)22(26)18-12-7-4-8-13-18/h3-8,10-13,19-20H,9,14-16H2,1-2H3/t19-,20?/m1/s1
InChIKeyRKUCRHDVEHIXGQ-FIWHBWSRSA-N
XLogP3.84
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(8-azabicyclo[3.2.1]octan-3-yl)-N-methylbenzamide;hydrochloride
CID 71758248
3-[methyl-(3-methylcyclohexyl)carbamoyl]benzoic acid
CID 61447304
N-cyclohexyl-4-hydroxy-N-methylbenzamide
CID 43176625
N-cyclopentyl-3-hydroxy-N-methylbenzamide
CID 43243153
3-amino-N-methyl-N-(3-methylcyclohexyl)benzamide;hydrochloride
CID 119717318
4-[benzenesulfonyl(methyl)amino]-N-cyclopentyl-N-methylbenzamide
CID 99950308
N-cyclohexyl-4-iodo-N-methylbenzamide
CID 30383969
N-[3,5-bis[methyl-(4-pyridin-2-ylbenzoyl)amino]cyclohexyl]-N-methyl-4-pyridin-2-ylbenzamide
CID 134179299
N-methyl-N-(2-oxocyclohexyl)benzamide
CID 10977310
3-bromo-N-cyclopentyl-N-methylbenzamide
CID 43213208
4-(benzenesulfonamido)-N-cyclohexyl-N-methylbenzamide
CID 28567343
benzoic acid;N,N-dimethylcyclohexanamine
CID 173305474

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide?
The IUPAC name of N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide (CID 143430707) is N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide.
What is the SMILES notation for N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide?
The canonical SMILES for N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide is CN(C(=O)c1ccccc1)C1CCC[C@@H](N(C)C(=O)c2ccccc2)C1.
What is the InChIKey of N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide?
The InChIKey is RKUCRHDVEHIXGQ-FIWHBWSRSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-23(21(25)17-10-5-3-6-11-17)19-14-9-15-20(16-19)24(2)22(26)18-12-7-4-8-13-18/h3-8,10-13,19-20H,9,14-16H2,1-2H3/t19-,20?/m1/s1.
What are the key properties of N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide?
N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide has a molecular weight of 350.46 g/mol, XLogP of 3.84, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide is sourced from PubChem (CID 143430707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).