N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide

C17H26N2O — CID 63107606

IUPACN-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide
SMILESCC(C)Nc1ccccc1C(=O)NC1CCCCC1C
InChIInChI=1S/C17H26N2O/c1-12(2)18-16-11-7-5-9-14(16)17(20)19-15-10-6-4-8-13(15)3/h5,7,9,11-13,15,18H,4,6,8,10H2,1-3H3,(H,19,20)
InChIKeyDHXGFYGFTPKQMU-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.82
Rot. Bonds4

About N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide

N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide (PubChem CID 63107606) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide.

Molecular Properties

Compound NameN-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide
PubChem CID63107606
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide
SMILESCC(C)Nc1ccccc1C(=O)NC1CCCCC1C
InChIInChI=1S/C17H26N2O/c1-12(2)18-16-11-7-5-9-14(16)17(20)19-15-10-6-4-8-13(15)3/h5,7,9,11-13,15,18H,4,6,8,10H2,1-3H3,(H,19,20)
InChIKeyDHXGFYGFTPKQMU-UHFFFAOYSA-N
XLogP3.82
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S,2S)-2-hydroxycyclohexyl]-2-(propan-2-ylamino)benzamide
CID 107223849
N-cycloheptyl-2-(propan-2-ylamino)benzamide
CID 63107657
2-methyl-N-[(1R,2S)-2-methylcyclohexyl]benzamide
CID 804412
2-fluoro-N-(2-methylcyclohexyl)benzamide
CID 51166100
N-[(1R)-2-methylcyclohexyl]benzamide
CID 137472316
N-[(1R)-1-cyclohexylethyl]-2-(propan-2-ylamino)benzamide
CID 81389065
3-hydroxy-2-methyl-N-(2-methylcycloheptyl)benzamide
CID 82829354
2-amino-N-(2-methylcyclohexyl)pyridine-3-carboxamide
CID 53334696
1-N,4-N-bis[(1S,2R)-2-methylcyclohexyl]benzene-1,4-dicarboxamide
CID 124805645
N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide
CID 63107544
2-methyl-N-[(1S,2R)-2-methylcyclohexyl]-6-phenylpyridine-3-carboxamide
CID 31847366
N-(2-methylcyclohexyl)-N'-(2-propan-2-ylphenyl)oxamide
CID 108500534

Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide?
The IUPAC name of N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide (CID 63107606) is N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide.
What is the SMILES notation for N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide?
The canonical SMILES for N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide is CC(C)Nc1ccccc1C(=O)NC1CCCCC1C.
What is the InChIKey of N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide?
The InChIKey is DHXGFYGFTPKQMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-12(2)18-16-11-7-5-9-14(16)17(20)19-15-10-6-4-8-13(15)3/h5,7,9,11-13,15,18H,4,6,8,10H2,1-3H3,(H,19,20).
What are the key properties of N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide?
N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide has a molecular weight of 274.41 g/mol, XLogP of 3.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide is sourced from PubChem (CID 63107606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).