N-methyl-N-(2-oxocyclohexyl)benzamide

C14H17NO2 — CID 10977310

IUPACN-methyl-N-(2-oxocyclohexyl)benzamide
SMILESCN(C(=O)c1ccccc1)C1CCCCC1=O
InChIInChI=1S/C14H17NO2/c1-15(12-9-5-6-10-13(12)16)14(17)11-7-3-2-4-8-11/h2-4,7-8,12H,5-6,9-10H2,1H3
InChIKeyIQRXMAXBAKKAPB-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.27
Rot. Bonds2

About N-methyl-N-(2-oxocyclohexyl)benzamide

N-methyl-N-(2-oxocyclohexyl)benzamide (PubChem CID 10977310) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is N-methyl-N-(2-oxocyclohexyl)benzamide.

Molecular Properties

Compound NameN-methyl-N-(2-oxocyclohexyl)benzamide
PubChem CID10977310
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC NameN-methyl-N-(2-oxocyclohexyl)benzamide
SMILESCN(C(=O)c1ccccc1)C1CCCCC1=O
InChIInChI=1S/C14H17NO2/c1-15(12-9-5-6-10-13(12)16)14(17)11-7-3-2-4-8-11/h2-4,7-8,12H,5-6,9-10H2,1H3
InChIKeyIQRXMAXBAKKAPB-UHFFFAOYSA-N
XLogP2.27
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3R)-3-[benzoyl(methyl)amino]cyclohexyl]-N-methylbenzamide
CID 143430707
N-[(1S,2E,3Z)-3-ethylidene-2-prop-2-enylidenecyclohexyl]-N-methylbenzamide
CID 143175426
ethane;N-[(1S,2E,3Z)-3-ethylidene-2-prop-2-enylidenecyclohexyl]-N-methylbenzamide
CID 143175425
2-benzoylcyclotridecan-1-one
CID 101422484
N-[(1R)-5-fluoro-2,3-dihydro-1H-inden-1-yl]-N-methylbenzamide
CID 144743792
N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 42884040
N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-4-carboxamide
CID 42916496
2-(3-oxo-3-phenylpropyl)cyclohexan-1-one
CID 2751330
(2R)-2-(3-oxo-3-phenylpropyl)cyclohexan-1-one
CID 712460
benzoic acid;N,N-dimethylcyclohexanamine
CID 173305474
N-[(1S,2R)-2-hydroxycyclohexyl]-N-methyl-4-phenylbenzamide
CID 27245407
2-(3-oxo-3-phenylpropyl)cycloheptan-1-one
CID 10824211

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-oxocyclohexyl)benzamide?
The IUPAC name of N-methyl-N-(2-oxocyclohexyl)benzamide (CID 10977310) is N-methyl-N-(2-oxocyclohexyl)benzamide.
What is the SMILES notation for N-methyl-N-(2-oxocyclohexyl)benzamide?
The canonical SMILES for N-methyl-N-(2-oxocyclohexyl)benzamide is CN(C(=O)c1ccccc1)C1CCCCC1=O.
What is the InChIKey of N-methyl-N-(2-oxocyclohexyl)benzamide?
The InChIKey is IQRXMAXBAKKAPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-15(12-9-5-6-10-13(12)16)14(17)11-7-3-2-4-8-11/h2-4,7-8,12H,5-6,9-10H2,1H3.
What are the key properties of N-methyl-N-(2-oxocyclohexyl)benzamide?
N-methyl-N-(2-oxocyclohexyl)benzamide has a molecular weight of 231.30 g/mol, XLogP of 2.27, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-oxocyclohexyl)benzamide is sourced from PubChem (CID 10977310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).