5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide

C13H15ClFNO2 — CID 103082452

IUPAC5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide
SMILESCOC1CCC(NC(=O)c2cc(Cl)ccc2F)C1
InChIInChI=1S/C13H15ClFNO2/c1-18-10-4-3-9(7-10)16-13(17)11-6-8(14)2-5-12(11)15/h2,5-6,9-10H,3-4,7H2,1H3,(H,16,17)
InChIKeyHKIMNAADVIICSI-UHFFFAOYSA-N
MW271.72 g/mol
LogP2.78
Rot. Bonds3

About 5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide

5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide (PubChem CID 103082452) has the molecular formula C13H15ClFNO2 and a molecular weight of 271.72 g/mol. Its IUPAC name is 5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide
PubChem CID103082452
Molecular FormulaC13H15ClFNO2
Molecular Weight271.72 g/mol
Exact Mass271.08
IUPAC Name5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide
SMILESCOC1CCC(NC(=O)c2cc(Cl)ccc2F)C1
InChIInChI=1S/C13H15ClFNO2/c1-18-10-4-3-9(7-10)16-13(17)11-6-8(14)2-5-12(11)15/h2,5-6,9-10H,3-4,7H2,1H3,(H,16,17)
InChIKeyHKIMNAADVIICSI-UHFFFAOYSA-N
XLogP2.78
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.72
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-(3-methoxycyclopentyl)-2-nitrobenzamide
CID 103082421
2-fluoro-N-(3-methoxycyclopentyl)-5-nitrobenzamide
CID 103097102
5-chloro-N-(3-ethoxycyclobutyl)-2-fluorobenzamide
CID 102610577
cis-(1R,3S)-3-[(5-chloro-2-fluorobenzoyl)amino]cyclopentane-1-carboxylic acid
CID 106321337
5-amino-2-fluoro-N-(3-methoxycyclobutyl)benzamide
CID 114118491
3-amino-4-fluoro-N-(3-methoxycyclopentyl)benzamide
CID 114117879
5-chloro-N-cycloheptyl-2-fluorobenzamide
CID 9082182
2,5-difluoro-N-(4-methoxycyclohexyl)-4-methylbenzamide
CID 136547195
5-chloro-2-fluoro-N-(3-methoxy-2,2-dimethylcyclobutyl)benzamide
CID 103742326
5-chloro-2-fluoro-N-(1-oxothian-4-yl)benzamide
CID 113347776
2,5-dichloro-N-[4-[(2,5-dichlorobenzoyl)amino]cyclohexyl]benzamide
CID 2165949
5-chloro-2-fluoro-N-(3,3,5,5-tetramethylcyclohexyl)benzamide
CID 103966065

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide?
The IUPAC name of 5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide (CID 103082452) is 5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide.
What is the SMILES notation for 5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide?
The canonical SMILES for 5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide is COC1CCC(NC(=O)c2cc(Cl)ccc2F)C1.
What is the InChIKey of 5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide?
The InChIKey is HKIMNAADVIICSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClFNO2/c1-18-10-4-3-9(7-10)16-13(17)11-6-8(14)2-5-12(11)15/h2,5-6,9-10H,3-4,7H2,1H3,(H,16,17).
What are the key properties of 5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide?
5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide has a molecular weight of 271.72 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-fluoro-N-(3-methoxycyclopentyl)benzamide is sourced from PubChem (CID 103082452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).