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

C17H26N2O — CID 63107657

IUPACN-cycloheptyl-2-(propan-2-ylamino)benzamide
SMILESCC(C)Nc1ccccc1C(=O)NC1CCCCCC1
InChIInChI=1S/C17H26N2O/c1-13(2)18-16-12-8-7-11-15(16)17(20)19-14-9-5-3-4-6-10-14/h7-8,11-14,18H,3-6,9-10H2,1-2H3,(H,19,20)
InChIKeyFQXALYCWAURFDR-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.96
Rot. Bonds4

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

N-cycloheptyl-2-(propan-2-ylamino)benzamide (PubChem CID 63107657) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-cycloheptyl-2-(propan-2-ylamino)benzamide.

Molecular Properties

Compound NameN-cycloheptyl-2-(propan-2-ylamino)benzamide
PubChem CID63107657
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-cycloheptyl-2-(propan-2-ylamino)benzamide
SMILESCC(C)Nc1ccccc1C(=O)NC1CCCCCC1
InChIInChI=1S/C17H26N2O/c1-13(2)18-16-12-8-7-11-15(16)17(20)19-14-9-5-3-4-6-10-14/h7-8,11-14,18H,3-6,9-10H2,1-2H3,(H,19,20)
InChIKeyFQXALYCWAURFDR-UHFFFAOYSA-N
XLogP3.96
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 ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-cycloheptyl-2-(propan-2-ylamino)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1R)-1-cyclohexylethyl]-2-(propan-2-ylamino)benzamide
CID 81389065
N-[(1S,2S)-2-hydroxycyclohexyl]-2-(propan-2-ylamino)benzamide
CID 107223849
2-[[(2S)-2-chloropropanoyl]amino]-N-cyclohexylbenzamide
CID 92660383
N-(2-methylcyclohexyl)-2-(propan-2-ylamino)benzamide
CID 63107606
N-cyclooctyl-2-(propylamino)benzamide
CID 63500402
N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 44761338
N-cyclopentyl-2-(2-methylsulfanylpropanoylamino)benzamide
CID 43077712
N-cyclohexyl-2-[[(2S)-2-(2,6-dimethylphenoxy)propanoyl]amino]benzamide
CID 9297462
2-(benzenesulfonamido)-N-cycloheptylbenzamide
CID 126412627
2-(acetylcarbamothioylamino)-N-cyclohexylbenzamide
CID 1226733
N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide
CID 63107544
N-cyclooctyl-2-(naphthalen-1-ylamino)benzamide
CID 17385247

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-(propan-2-ylamino)benzamide?
The IUPAC name of N-cycloheptyl-2-(propan-2-ylamino)benzamide (CID 63107657) is N-cycloheptyl-2-(propan-2-ylamino)benzamide.
What is the SMILES notation for N-cycloheptyl-2-(propan-2-ylamino)benzamide?
The canonical SMILES for N-cycloheptyl-2-(propan-2-ylamino)benzamide is CC(C)Nc1ccccc1C(=O)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-2-(propan-2-ylamino)benzamide?
The InChIKey is FQXALYCWAURFDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-13(2)18-16-12-8-7-11-15(16)17(20)19-14-9-5-3-4-6-10-14/h7-8,11-14,18H,3-6,9-10H2,1-2H3,(H,19,20).
What are the key properties of N-cycloheptyl-2-(propan-2-ylamino)benzamide?
N-cycloheptyl-2-(propan-2-ylamino)benzamide has a molecular weight of 274.41 g/mol, XLogP of 3.96, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-(propan-2-ylamino)benzamide is sourced from PubChem (CID 63107657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).