5-amino-N-cyclopentyl-2,4-difluorobenzamide

C12H14F2N2O — CID 61091643

IUPAC5-amino-N-cyclopentyl-2,4-difluorobenzamide
SMILESNc1cc(C(=O)NC2CCCC2)c(F)cc1F
InChIInChI=1S/C12H14F2N2O/c13-9-6-10(14)11(15)5-8(9)12(17)16-7-3-1-2-4-7/h5-7H,1-4,15H2,(H,16,17)
InChIKeySRMPMCXEBGJYLZ-UHFFFAOYSA-N
MW240.25 g/mol
LogP2.22
Rot. Bonds2

About 5-amino-N-cyclopentyl-2,4-difluorobenzamide

5-amino-N-cyclopentyl-2,4-difluorobenzamide (PubChem CID 61091643) has the molecular formula C12H14F2N2O and a molecular weight of 240.25 g/mol. Its IUPAC name is 5-amino-N-cyclopentyl-2,4-difluorobenzamide.

Molecular Properties

Compound Name5-amino-N-cyclopentyl-2,4-difluorobenzamide
PubChem CID61091643
Molecular FormulaC12H14F2N2O
Molecular Weight240.25 g/mol
Exact Mass240.11
IUPAC Name5-amino-N-cyclopentyl-2,4-difluorobenzamide
SMILESNc1cc(C(=O)NC2CCCC2)c(F)cc1F
InChIInChI=1S/C12H14F2N2O/c13-9-6-10(14)11(15)5-8(9)12(17)16-7-3-1-2-4-7/h5-7H,1-4,15H2,(H,16,17)
InChIKeySRMPMCXEBGJYLZ-UHFFFAOYSA-N
XLogP2.22
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.25
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5-amino-N-cyclopentyl-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-amino-2-bromo-N-cyclooctyl-4-fluorobenzamide
CID 62815067
5-amino-N-(1,1-dioxothiolan-3-yl)-2,4-difluorobenzamide
CID 61090998
5-amino-N-(2-cyclopentylethyl)-2,4-difluorobenzamide
CID 61102915
2-amino-N-cycloheptyl-4-fluorobenzamide
CID 55139018
4-amino-N-cyclooctyl-3-fluorobenzamide
CID 62679448
5-chloro-N-cycloheptyl-2-fluorobenzamide
CID 9082182
4-chloro-N-cycloheptyl-2-fluorobenzamide
CID 26002204
2-bromo-5-(cyclopentylcarbamoyl)-4-fluorobenzenesulfonyl chloride
CID 65367755
N-cyclobutyl-2,4-difluorobenzamide
CID 70247338
N-cyclobutyl-2-fluoro-5-hydroxy-4-methylbenzamide
CID 171906052
2-amino-N-cyclohexyl-3-fluorobenzamide
CID 55099758
5-amino-2,4-difluoro-N-(3-hydroxy-2,2-dimethylcyclobutyl)benzamide
CID 114628200

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-cyclopentyl-2,4-difluorobenzamide?
The IUPAC name of 5-amino-N-cyclopentyl-2,4-difluorobenzamide (CID 61091643) is 5-amino-N-cyclopentyl-2,4-difluorobenzamide.
What is the SMILES notation for 5-amino-N-cyclopentyl-2,4-difluorobenzamide?
The canonical SMILES for 5-amino-N-cyclopentyl-2,4-difluorobenzamide is Nc1cc(C(=O)NC2CCCC2)c(F)cc1F.
What is the InChIKey of 5-amino-N-cyclopentyl-2,4-difluorobenzamide?
The InChIKey is SRMPMCXEBGJYLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F2N2O/c13-9-6-10(14)11(15)5-8(9)12(17)16-7-3-1-2-4-7/h5-7H,1-4,15H2,(H,16,17).
What are the key properties of 5-amino-N-cyclopentyl-2,4-difluorobenzamide?
5-amino-N-cyclopentyl-2,4-difluorobenzamide has a molecular weight of 240.25 g/mol, XLogP of 2.22, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-cyclopentyl-2,4-difluorobenzamide is sourced from PubChem (CID 61091643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).