2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide

C17H26N2O — CID 61214396

IUPAC2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
SMILESCC1CCC(C(C)C)C(NC(=O)c2ccccc2N)C1
InChIInChI=1S/C17H26N2O/c1-11(2)13-9-8-12(3)10-16(13)19-17(20)14-6-4-5-7-15(14)18/h4-7,11-13,16H,8-10,18H2,1-3H3,(H,19,20)
InChIKeyBGYMMLGKGKVIBT-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.46
Rot. Bonds3

About 2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide

2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide (PubChem CID 61214396) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide.

Molecular Properties

Compound Name2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
PubChem CID61214396
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
SMILESCC1CCC(C(C)C)C(NC(=O)c2ccccc2N)C1
InChIInChI=1S/C17H26N2O/c1-11(2)13-9-8-12(3)10-16(13)19-17(20)14-6-4-5-7-15(14)18/h4-7,11-13,16H,8-10,18H2,1-3H3,(H,19,20)
InChIKeyBGYMMLGKGKVIBT-UHFFFAOYSA-N
XLogP3.46
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(methylamino)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
CID 63552614
N-[(1R,5R)-5-methyl-2-propan-2-ylcyclohexyl]-4-phenylbenzamide
CID 126621339
2,4-dibromo-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
CID 107951942
2,6-dichloro-N-[(1R,2S,5S)-5-methyl-2-propan-2-ylcyclohexyl]benzamide
CID 6932663
5-chloro-2-fluoro-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
CID 63483142
N-(5-methyl-2-propan-2-ylcyclohexyl)-1H-indazole-7-carboxamide
CID 60547804
(5-methyl-2-propan-2-ylcyclohexyl) 2-aminobenzoate
CID 8633
3-chloro-N-(5-methyl-2-propan-2-ylcyclohexyl)pyridine-4-carboxamide
CID 66482936
5-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)-1H-pyrazole-4-carboxamide
CID 63997417
2-amino-N-(2-methoxycyclopentyl)benzamide
CID 62086922
N-(5-methyl-2-propan-2-ylcyclohexyl)thiadiazole-5-carboxamide
CID 47350810
N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide
CID 47234721

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide?
The IUPAC name of 2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide (CID 61214396) is 2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide.
What is the SMILES notation for 2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide?
The canonical SMILES for 2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide is CC1CCC(C(C)C)C(NC(=O)c2ccccc2N)C1.
What is the InChIKey of 2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide?
The InChIKey is BGYMMLGKGKVIBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-11(2)13-9-8-12(3)10-16(13)19-17(20)14-6-4-5-7-15(14)18/h4-7,11-13,16H,8-10,18H2,1-3H3,(H,19,20).
What are the key properties of 2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide?
2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide has a molecular weight of 274.41 g/mol, XLogP of 3.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide is sourced from PubChem (CID 61214396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).