2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide

C13H17FN2O — CID 63279485

IUPAC2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide
SMILESCC1CCCC1NC(=O)c1cccc(F)c1N
InChIInChI=1S/C13H17FN2O/c1-8-4-2-7-11(8)16-13(17)9-5-3-6-10(14)12(9)15/h3,5-6,8,11H,2,4,7,15H2,1H3,(H,16,17)
InChIKeyWCQOOQFZQKMEOL-UHFFFAOYSA-N
MW236.29 g/mol
LogP2.33
Rot. Bonds2

About 2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide

2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide (PubChem CID 63279485) has the molecular formula C13H17FN2O and a molecular weight of 236.29 g/mol. Its IUPAC name is 2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide.

Molecular Properties

Compound Name2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide
PubChem CID63279485
Molecular FormulaC13H17FN2O
Molecular Weight236.29 g/mol
Exact Mass236.13
IUPAC Name2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide
SMILESCC1CCCC1NC(=O)c1cccc(F)c1N
InChIInChI=1S/C13H17FN2O/c1-8-4-2-7-11(8)16-13(17)9-5-3-6-10(14)12(9)15/h3,5-6,8,11H,2,4,7,15H2,1H3,(H,16,17)
InChIKeyWCQOOQFZQKMEOL-UHFFFAOYSA-N
XLogP2.33
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.29
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-fluoro-N-(2-methylcyclohexyl)benzamide
CID 51166100
2-amino-N-cyclohexyl-3-fluorobenzamide
CID 55099758
3-amino-4-fluoro-N-(2-methylcyclopentyl)-1-benzothiophene-2-carboxamide
CID 79510859
3-amino-N-(2-methylcyclopentyl)-2-nitrobenzamide
CID 115549026
3-amino-4-fluoro-N-(2-methylcyclohexyl)-1-benzothiophene-2-carboxamide
CID 79517182
2-amino-N-(2-methylcyclohexyl)pyridine-3-carboxamide
CID 53334696
2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide
CID 55171474
N-[(1R,2S,3R)-2,3-dimethylcyclohexyl]-2,6-difluorobenzamide
CID 124811505
N-(2,3-dimethylcyclohexyl)-2-fluoro-3-methylbenzamide
CID 80718134
2-amino-4-fluoro-N-(2-methylcyclohexyl)benzamide
CID 62073290
2-methyl-N-[(1R,2S)-2-methylcyclohexyl]benzamide
CID 804412
3-hydroxy-2-methyl-N-(2-methylcycloheptyl)benzamide
CID 82829354

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide?
The IUPAC name of 2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide (CID 63279485) is 2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide.
What is the SMILES notation for 2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide?
The canonical SMILES for 2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide is CC1CCCC1NC(=O)c1cccc(F)c1N.
What is the InChIKey of 2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide?
The InChIKey is WCQOOQFZQKMEOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O/c1-8-4-2-7-11(8)16-13(17)9-5-3-6-10(14)12(9)15/h3,5-6,8,11H,2,4,7,15H2,1H3,(H,16,17).
What are the key properties of 2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide?
2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide has a molecular weight of 236.29 g/mol, XLogP of 2.33, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-fluoro-N-(2-methylcyclopentyl)benzamide is sourced from PubChem (CID 63279485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).