4-chloro-N-(4-propylcyclohexyl)benzamide

C16H22ClNO — CID 10612734

IUPAC4-chloro-N-(4-propylcyclohexyl)benzamide
SMILESCCCC1CCC(NC(=O)c2ccc(Cl)cc2)CC1
InChIInChI=1S/C16H22ClNO/c1-2-3-12-4-10-15(11-5-12)18-16(19)13-6-8-14(17)9-7-13/h6-9,12,15H,2-5,10-11H2,1H3,(H,18,19)
InChIKeyHNFQYMZHTUCSMX-UHFFFAOYSA-N
MW279.81 g/mol
LogP4.43
Rot. Bonds4

About 4-chloro-N-(4-propylcyclohexyl)benzamide

4-chloro-N-(4-propylcyclohexyl)benzamide (PubChem CID 10612734) has the molecular formula C16H22ClNO and a molecular weight of 279.81 g/mol. Its IUPAC name is 4-chloro-N-(4-propylcyclohexyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-(4-propylcyclohexyl)benzamide
PubChem CID10612734
Molecular FormulaC16H22ClNO
Molecular Weight279.81 g/mol
Exact Mass279.14
IUPAC Name4-chloro-N-(4-propylcyclohexyl)benzamide
SMILESCCCC1CCC(NC(=O)c2ccc(Cl)cc2)CC1
InChIInChI=1S/C16H22ClNO/c1-2-3-12-4-10-15(11-5-12)18-16(19)13-6-8-14(17)9-7-13/h6-9,12,15H,2-5,10-11H2,1H3,(H,18,19)
InChIKeyHNFQYMZHTUCSMX-UHFFFAOYSA-N
XLogP4.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.81
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[(4-propylcyclohexyl)carbamoyl]benzoic acid
CID 61409748
1-N,3-N,5-N-tris(4-propylcyclohexyl)benzene-1,3,5-tricarboxamide
CID 67413322
4-bromo-3-chloro-N-(4-propylcyclohexyl)benzamide
CID 81308175
N-(4-aminocyclohexyl)-4-chlorobenzamide;hydrochloride
CID 86277368
4-hydroxy-3-methyl-N-(4-propylcyclohexyl)benzamide
CID 107676630
4-chloro-N-[1-[(4-ethylcyclohexyl)amino]-1-oxopropan-2-yl]benzamide
CID 112817108
3-(chloromethyl)-N-(4-propylcyclohexyl)benzamide
CID 63463700
5-[(4-propylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid
CID 61380872
2-amino-6-chloro-N-(4-propylcyclohexyl)pyridine-4-carboxamide
CID 62161947
N-[4-(2-hydroxyethyl)cyclohexyl]-4-propan-2-ylbenzamide
CID 143724454
5-bromo-2-fluoro-N-(4-propylcyclohexyl)benzamide
CID 63524250
2-chloro-6-(methylamino)-N-(4-propylcyclohexyl)pyridine-4-carboxamide
CID 63499717

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-propylcyclohexyl)benzamide?
The IUPAC name of 4-chloro-N-(4-propylcyclohexyl)benzamide (CID 10612734) is 4-chloro-N-(4-propylcyclohexyl)benzamide.
What is the SMILES notation for 4-chloro-N-(4-propylcyclohexyl)benzamide?
The canonical SMILES for 4-chloro-N-(4-propylcyclohexyl)benzamide is CCCC1CCC(NC(=O)c2ccc(Cl)cc2)CC1.
What is the InChIKey of 4-chloro-N-(4-propylcyclohexyl)benzamide?
The InChIKey is HNFQYMZHTUCSMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22ClNO/c1-2-3-12-4-10-15(11-5-12)18-16(19)13-6-8-14(17)9-7-13/h6-9,12,15H,2-5,10-11H2,1H3,(H,18,19).
What are the key properties of 4-chloro-N-(4-propylcyclohexyl)benzamide?
4-chloro-N-(4-propylcyclohexyl)benzamide has a molecular weight of 279.81 g/mol, XLogP of 4.43, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(4-propylcyclohexyl)benzamide is sourced from PubChem (CID 10612734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).