3-[(4-propylcyclohexyl)amino]benzamide

C16H24N2O — CID 28540902

IUPAC3-[(4-propylcyclohexyl)amino]benzamide
SMILESCCCC1CCC(Nc2cccc(C(N)=O)c2)CC1
InChIInChI=1S/C16H24N2O/c1-2-4-12-7-9-14(10-8-12)18-15-6-3-5-13(11-15)16(17)19/h3,5-6,11-12,14,18H,2,4,7-10H2,1H3,(H2,17,19)
InChIKeyDUBDBPIRHJKMDC-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.56
Rot. Bonds5

About 3-[(4-propylcyclohexyl)amino]benzamide

3-[(4-propylcyclohexyl)amino]benzamide (PubChem CID 28540902) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 3-[(4-propylcyclohexyl)amino]benzamide.

Molecular Properties

Compound Name3-[(4-propylcyclohexyl)amino]benzamide
PubChem CID28540902
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name3-[(4-propylcyclohexyl)amino]benzamide
SMILESCCCC1CCC(Nc2cccc(C(N)=O)c2)CC1
InChIInChI=1S/C16H24N2O/c1-2-4-12-7-9-14(10-8-12)18-15-6-3-5-13(11-15)16(17)19/h3,5-6,11-12,14,18H,2,4,7-10H2,1H3,(H2,17,19)
InChIKeyDUBDBPIRHJKMDC-UHFFFAOYSA-N
XLogP3.56
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 3-[(4-propylcyclohexyl)amino]benzoate
CID 43139424
2-amino-3-[(4-propylcyclohexyl)amino]benzamide
CID 115545356
3-(difluoromethoxy)-N-(4-propylcyclohexyl)aniline
CID 43698673
3-[(3,3-dimethylcyclopentyl)amino]benzamide
CID 80693382
3-[(4-aminocyclohexyl)amino]-N,N-dimethylbenzamide
CID 79731247
2-fluoro-4-[(4-propylcyclohexyl)amino]benzoic acid
CID 115485237
N-cyclopropyl-3-(cyclopropylamino)benzamide
CID 103438850
3-(1,4-dioxaspiro[4.5]decan-8-ylamino)benzamide
CID 28650668
N,N-dimethyl-3-[(4-methylcyclohexyl)amino]benzamide
CID 43725406
2,4-difluoro-5-[(4-propylcyclohexyl)amino]benzamide
CID 43673699
3-[(2,6-dimethylcyclohexyl)amino]benzamide
CID 43202843
N-methyl-2-[4-[(4-propylcyclohexyl)amino]phenyl]acetamide
CID 43713892

Frequently Asked Questions

What is the IUPAC name of 3-[(4-propylcyclohexyl)amino]benzamide?
The IUPAC name of 3-[(4-propylcyclohexyl)amino]benzamide (CID 28540902) is 3-[(4-propylcyclohexyl)amino]benzamide.
What is the SMILES notation for 3-[(4-propylcyclohexyl)amino]benzamide?
The canonical SMILES for 3-[(4-propylcyclohexyl)amino]benzamide is CCCC1CCC(Nc2cccc(C(N)=O)c2)CC1.
What is the InChIKey of 3-[(4-propylcyclohexyl)amino]benzamide?
The InChIKey is DUBDBPIRHJKMDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-4-12-7-9-14(10-8-12)18-15-6-3-5-13(11-15)16(17)19/h3,5-6,11-12,14,18H,2,4,7-10H2,1H3,(H2,17,19).
What are the key properties of 3-[(4-propylcyclohexyl)amino]benzamide?
3-[(4-propylcyclohexyl)amino]benzamide has a molecular weight of 260.38 g/mol, XLogP of 3.56, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-propylcyclohexyl)amino]benzamide is sourced from PubChem (CID 28540902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).