2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine

C12H13F2N3 — CID 64814538

IUPAC2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine
SMILESNC1CCCC1c1nc2cc(F)c(F)cc2[nH]1
InChIInChI=1S/C12H13F2N3/c13-7-4-10-11(5-8(7)14)17-12(16-10)6-2-1-3-9(6)15/h4-6,9H,1-3,15H2,(H,16,17)
InChIKeyYEWGKLPXGSYCQB-UHFFFAOYSA-N
MW237.25 g/mol
LogP2.44
Rot. Bonds1

About 2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine

2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine (PubChem CID 64814538) has the molecular formula C12H13F2N3 and a molecular weight of 237.25 g/mol. Its IUPAC name is 2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine
PubChem CID64814538
Molecular FormulaC12H13F2N3
Molecular Weight237.25 g/mol
Exact Mass237.11
IUPAC Name2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine
SMILESNC1CCCC1c1nc2cc(F)c(F)cc2[nH]1
InChIInChI=1S/C12H13F2N3/c13-7-4-10-11(5-8(7)14)17-12(16-10)6-2-1-3-9(6)15/h4-6,9H,1-3,15H2,(H,16,17)
InChIKeyYEWGKLPXGSYCQB-UHFFFAOYSA-N
XLogP2.44
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.25
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine
CID 64812865
2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine
CID 64814123
2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclohexan-1-amine
CID 64813916
(1R)-2-(1H-benzimidazol-2-yl)cyclopentan-1-amine
CID 175378525
2-(3H-imidazo[4,5-c]pyridin-2-yl)cyclopentan-1-amine
CID 64812457
[2-(5,6-dichloro-1H-benzimidazol-2-yl)cyclopentyl]methanamine
CID 82001526
2-(7H-purin-8-yl)cyclopentan-1-amine
CID 114402064
2-(2,3,3a,4,5,6,7,7a-octahydro-1H-indol-2-yl)-5,6-difluoro-1H-benzimidazole
CID 43470893
2-(4-chloro-1H-benzimidazol-2-yl)cyclopentan-1-amine
CID 64812039
(1R)-2-[6-methyl-4-(trifluoromethyl)-1H-benzimidazol-2-yl]cyclohexan-1-amine
CID 90261891
2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)cyclopentan-1-amine
CID 79815882
cis-(1S,3R)-3-(5-bromo-6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine
CID 106322566

Frequently Asked Questions

What is the IUPAC name of 2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine?
The IUPAC name of 2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine (CID 64814538) is 2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine.
What is the SMILES notation for 2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine?
The canonical SMILES for 2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine is NC1CCCC1c1nc2cc(F)c(F)cc2[nH]1.
What is the InChIKey of 2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine?
The InChIKey is YEWGKLPXGSYCQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13F2N3/c13-7-4-10-11(5-8(7)14)17-12(16-10)6-2-1-3-9(6)15/h4-6,9H,1-3,15H2,(H,16,17).
What are the key properties of 2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine?
2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine has a molecular weight of 237.25 g/mol, XLogP of 2.44, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-difluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 64814538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).