5-(cyclohexylamino)-2,4-difluorobenzamide

C13H16F2N2O — CID 43673780

IUPAC5-(cyclohexylamino)-2,4-difluorobenzamide
SMILESNC(=O)c1cc(NC2CCCCC2)c(F)cc1F
InChIInChI=1S/C13H16F2N2O/c14-10-7-11(15)12(6-9(10)13(16)18)17-8-4-2-1-3-5-8/h6-8,17H,1-5H2,(H2,16,18)
InChIKeyKYNGKTTZGGIJTN-UHFFFAOYSA-N
MW254.28 g/mol
LogP2.81
Rot. Bonds3

About 5-(cyclohexylamino)-2,4-difluorobenzamide

5-(cyclohexylamino)-2,4-difluorobenzamide (PubChem CID 43673780) has the molecular formula C13H16F2N2O and a molecular weight of 254.28 g/mol. Its IUPAC name is 5-(cyclohexylamino)-2,4-difluorobenzamide.

Molecular Properties

Compound Name5-(cyclohexylamino)-2,4-difluorobenzamide
PubChem CID43673780
Molecular FormulaC13H16F2N2O
Molecular Weight254.28 g/mol
Exact Mass254.12
IUPAC Name5-(cyclohexylamino)-2,4-difluorobenzamide
SMILESNC(=O)c1cc(NC2CCCCC2)c(F)cc1F
InChIInChI=1S/C13H16F2N2O/c14-10-7-11(15)12(6-9(10)13(16)18)17-8-4-2-1-3-5-8/h6-8,17H,1-5H2,(H2,16,18)
InChIKeyKYNGKTTZGGIJTN-UHFFFAOYSA-N
XLogP2.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.28
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-(cyclohexylamino)-2,4-difluorobenzamide 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

5-(cycloheptylamino)-2,4-difluorobenzoic acid
CID 43737089
5-(cyclopentylamino)-2,4-difluorobenzoic acid
CID 43737090
2,4-difluoro-5-[(3-methoxycyclohexyl)amino]benzamide
CID 106871627
2,4-difluoro-5-[(4-propylcyclohexyl)amino]benzamide
CID 43673699
2,4-difluoro-5-[(5-methylthiolan-3-yl)amino]benzamide
CID 79941342
5-[(2,3-dimethylcyclohexyl)amino]-2,4-difluorobenzamide
CID 64761802
5-(dicyclopropylmethylamino)-2,4-difluorobenzamide
CID 43673804
2,4-difluoro-5-[(2-methylthian-3-yl)amino]benzamide
CID 79956737
2-(cyclohexylamino)-4,5-difluorobenzoic acid
CID 82933532
3-N-cyclopentyl-4,6-difluorobenzene-1,3-diamine
CID 82933880
2,4-difluoro-5-[(2-methyloxolan-3-yl)amino]benzamide
CID 82727285
3-(cyclopentylamino)-5-fluoro-4-methylbenzamide
CID 43735724

Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexylamino)-2,4-difluorobenzamide?
The IUPAC name of 5-(cyclohexylamino)-2,4-difluorobenzamide (CID 43673780) is 5-(cyclohexylamino)-2,4-difluorobenzamide.
What is the SMILES notation for 5-(cyclohexylamino)-2,4-difluorobenzamide?
The canonical SMILES for 5-(cyclohexylamino)-2,4-difluorobenzamide is NC(=O)c1cc(NC2CCCCC2)c(F)cc1F.
What is the InChIKey of 5-(cyclohexylamino)-2,4-difluorobenzamide?
The InChIKey is KYNGKTTZGGIJTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N2O/c14-10-7-11(15)12(6-9(10)13(16)18)17-8-4-2-1-3-5-8/h6-8,17H,1-5H2,(H2,16,18).
What are the key properties of 5-(cyclohexylamino)-2,4-difluorobenzamide?
5-(cyclohexylamino)-2,4-difluorobenzamide has a molecular weight of 254.28 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexylamino)-2,4-difluorobenzamide is sourced from PubChem (CID 43673780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).