N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide

C15H19Cl2FN2O — CID 83077775

IUPACN-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide
SMILESCC(Nc1c(Cl)cc(F)cc1Cl)C(=O)NC1CCCCC1
InChIInChI=1S/C15H19Cl2FN2O/c1-9(15(21)20-11-5-3-2-4-6-11)19-14-12(16)7-10(18)8-13(14)17/h7-9,11,19H,2-6H2,1H3,(H,20,21)
InChIKeyCNPTVLNWRDECHW-UHFFFAOYSA-N
MW333.23 g/mol
LogP4.38
Rot. Bonds4

About N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide

N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide (PubChem CID 83077775) has the molecular formula C15H19Cl2FN2O and a molecular weight of 333.23 g/mol. Its IUPAC name is N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide
PubChem CID83077775
Molecular FormulaC15H19Cl2FN2O
Molecular Weight333.23 g/mol
Exact Mass332.09
IUPAC NameN-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide
SMILESCC(Nc1c(Cl)cc(F)cc1Cl)C(=O)NC1CCCCC1
InChIInChI=1S/C15H19Cl2FN2O/c1-9(15(21)20-11-5-3-2-4-6-11)19-14-12(16)7-10(18)8-13(14)17/h7-9,11,19H,2-6H2,1H3,(H,20,21)
InChIKeyCNPTVLNWRDECHW-UHFFFAOYSA-N
XLogP4.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.23
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide 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-cyclohexyl-2-(3-fluoro-5-methylanilino)propanamide
CID 79055402
2-(3-chloro-4-fluoroanilino)-N-cyclohexylpropanamide
CID 78907261
N-cyclohexyl-2-(3-fluoroanilino)propanamide
CID 43083427
2-(2-bromo-4,6-difluoroanilino)-N-cyclopropylpropanamide
CID 43347726
N-cyclohexyl-2-(3,5-dimethylanilino)propanamide
CID 43083597
(2R)-N-cyclopentyl-2-(2,5-dimethylanilino)propanamide
CID 28827851
2-(5-bromo-2,4-difluoroanilino)-N-cyclohexylpropanamide
CID 102853387
2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide
CID 82889686
2-(2,6-dichloro-4-fluoroanilino)-N-(ethylcarbamoyl)propanamide
CID 83079489
(2R)-2-[(2-chloro-4-fluorophenyl)methylsulfonyl]-N-cyclohexylpropanamide
CID 51727076
2-(3-chloro-4-cyanoanilino)-N-cyclopentylpropanamide
CID 43168430
2-(5-chloro-2-methoxyanilino)-N-cyclohexylpropanamide
CID 43083885

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide?
The IUPAC name of N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide (CID 83077775) is N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide.
What is the SMILES notation for N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide?
The canonical SMILES for N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide is CC(Nc1c(Cl)cc(F)cc1Cl)C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide?
The InChIKey is CNPTVLNWRDECHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19Cl2FN2O/c1-9(15(21)20-11-5-3-2-4-6-11)19-14-12(16)7-10(18)8-13(14)17/h7-9,11,19H,2-6H2,1H3,(H,20,21).
What are the key properties of N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide?
N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide has a molecular weight of 333.23 g/mol, XLogP of 4.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide is sourced from PubChem (CID 83077775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).