2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide

C13H17FN2O2 — CID 62366282

IUPAC2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide
SMILESNc1ccc(F)cc1C(=O)NC1CCCCC1O
InChIInChI=1S/C13H17FN2O2/c14-8-5-6-10(15)9(7-8)13(18)16-11-3-1-2-4-12(11)17/h5-7,11-12,17H,1-4,15H2,(H,16,18)
InChIKeyPFRGEPKXFDUWBI-UHFFFAOYSA-N
MW252.29 g/mol
LogP1.44
Rot. Bonds2

About 2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide

2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide (PubChem CID 62366282) has the molecular formula C13H17FN2O2 and a molecular weight of 252.29 g/mol. Its IUPAC name is 2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide.

Molecular Properties

Compound Name2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide
PubChem CID62366282
Molecular FormulaC13H17FN2O2
Molecular Weight252.29 g/mol
Exact Mass252.13
IUPAC Name2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide
SMILESNc1ccc(F)cc1C(=O)NC1CCCCC1O
InChIInChI=1S/C13H17FN2O2/c14-8-5-6-10(15)9(7-8)13(18)16-11-3-1-2-4-12(11)17/h5-7,11-12,17H,1-4,15H2,(H,16,18)
InChIKeyPFRGEPKXFDUWBI-UHFFFAOYSA-N
XLogP1.44
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 51.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 2-amino-5-fluoro-N-(2-hydroxycyclohexyl)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

2,5-difluoro-N-(2-hydroxycyclopentyl)benzamide
CID 43835745
2-amino-N-cyclopropyl-5-fluorobenzamide
CID 22493342
2-amino-5-fluoro-N-(2-methoxycyclopentyl)benzamide
CID 62086919
2-amino-5-fluoro-N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)benzamide
CID 43696372
2-amino-4-bromo-N-[(1R,2R)-2-hydroxycyclohexyl]benzamide
CID 107221910
5-amino-N-(2-hydroxycyclohexyl)-2,4-dimethylbenzamide
CID 102705498
2-amino-4-fluoro-N-(2-methylcyclohexyl)benzamide
CID 62073290
5-amino-2-bromo-N-(2-hydroxycyclohexyl)benzamide
CID 62365234
4-amino-3-bromo-N-[(1S,2S)-2-hydroxycyclohexyl]benzamide
CID 107221679
2-amino-5-fluoro-N-(2-oxoazepan-3-yl)benzamide
CID 43704077
4-[(2-amino-5-fluorobenzoyl)amino]cyclohexane-1-carboxylic acid
CID 61160859
2-amino-N-(cyclohexylmethyl)-5-fluorobenzamide
CID 43371580

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide?
The IUPAC name of 2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide (CID 62366282) is 2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide.
What is the SMILES notation for 2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide?
The canonical SMILES for 2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide is Nc1ccc(F)cc1C(=O)NC1CCCCC1O.
What is the InChIKey of 2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide?
The InChIKey is PFRGEPKXFDUWBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O2/c14-8-5-6-10(15)9(7-8)13(18)16-11-3-1-2-4-12(11)17/h5-7,11-12,17H,1-4,15H2,(H,16,18).
What are the key properties of 2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide?
2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide has a molecular weight of 252.29 g/mol, XLogP of 1.44, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-fluoro-N-(2-hydroxycyclohexyl)benzamide is sourced from PubChem (CID 62366282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).