N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide

C13H17FN2O2 — CID 63251639

IUPACN-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CCCC2N)cc1F
InChIInChI=1S/C13H17FN2O2/c1-18-12-6-5-8(7-9(12)14)13(17)16-11-4-2-3-10(11)15/h5-7,10-11H,2-4,15H2,1H3,(H,16,17)
InChIKeyDLYNLKUTFQDOOD-UHFFFAOYSA-N
MW252.29 g/mol
LogP1.44
Rot. Bonds3

About N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide

N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide (PubChem CID 63251639) has the molecular formula C13H17FN2O2 and a molecular weight of 252.29 g/mol. Its IUPAC name is N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide.

Molecular Properties

Compound NameN-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide
PubChem CID63251639
Molecular FormulaC13H17FN2O2
Molecular Weight252.29 g/mol
Exact Mass252.13
IUPAC NameN-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CCCC2N)cc1F
InChIInChI=1S/C13H17FN2O2/c1-18-12-6-5-8(7-9(12)14)13(17)16-11-4-2-3-10(11)15/h5-7,10-11H,2-4,15H2,1H3,(H,16,17)
InChIKeyDLYNLKUTFQDOOD-UHFFFAOYSA-N
XLogP1.44
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(chloromethyl)cyclopentyl]-3-fluoro-4-methoxybenzamide
CID 106366034
3-fluoro-N-[2-(N'-hydroxycarbamimidoyl)cyclopentyl]-4-methoxybenzamide
CID 76978535
N-[2-(chloromethyl)cyclohexyl]-3-fluoro-4-methoxybenzamide
CID 106366906
N-(2-aminocyclohexyl)-3-fluoro-4-methylbenzamide
CID 61038354
N-(2-aminocyclopentyl)-3-methoxy-4-nitrobenzamide
CID 104783797
N-[(1S,2S)-2-aminocyclopentyl]-2-fluoro-6-methoxybenzamide
CID 118308174
N-[(1R,2R)-2-aminocyclohexyl]-4-chloro-3-fluorobenzamide
CID 114024825
N-(2-aminocyclopentyl)-2-methoxy-5-methylbenzamide
CID 63251447
N-[(1R,2S)-2-aminocyclopentyl]-2,6-dimethoxybenzamide
CID 122452181
N-[(1S,2S)-2-aminocyclopentyl]-2,6-dimethoxybenzamide
CID 118308160
N-(2-aminocyclopentyl)-4-fluoro-3-(trifluoromethyl)benzamide
CID 63251637
N-[2-(hydroxymethyl)cyclopentyl]-3,4-dimethoxybenzamide
CID 103751338

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide?
The IUPAC name of N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide (CID 63251639) is N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide.
What is the SMILES notation for N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide?
The canonical SMILES for N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide is COc1ccc(C(=O)NC2CCCC2N)cc1F.
What is the InChIKey of N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide?
The InChIKey is DLYNLKUTFQDOOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O2/c1-18-12-6-5-8(7-9(12)14)13(17)16-11-4-2-3-10(11)15/h5-7,10-11H,2-4,15H2,1H3,(H,16,17).
What are the key properties of N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide?
N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide has a molecular weight of 252.29 g/mol, XLogP of 1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopentyl)-3-fluoro-4-methoxybenzamide is sourced from PubChem (CID 63251639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).