2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine

C12H14FN3 — CID 64812865

IUPAC2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine
SMILESNC1CCCC1c1nc2ccc(F)cc2[nH]1
InChIInChI=1S/C12H14FN3/c13-7-4-5-10-11(6-7)16-12(15-10)8-2-1-3-9(8)14/h4-6,8-9H,1-3,14H2,(H,15,16)
InChIKeyDRVWKWNJBKGKQR-UHFFFAOYSA-N
MW219.26 g/mol
LogP2.30
Rot. Bonds1

About 2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine

2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine (PubChem CID 64812865) has the molecular formula C12H14FN3 and a molecular weight of 219.26 g/mol. Its IUPAC name is 2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine
PubChem CID64812865
Molecular FormulaC12H14FN3
Molecular Weight219.26 g/mol
Exact Mass219.12
IUPAC Name2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine
SMILESNC1CCCC1c1nc2ccc(F)cc2[nH]1
InChIInChI=1S/C12H14FN3/c13-7-4-5-10-11(6-7)16-12(15-10)8-2-1-3-9(8)14/h4-6,8-9H,1-3,14H2,(H,15,16)
InChIKeyDRVWKWNJBKGKQR-UHFFFAOYSA-N
XLogP2.30
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine?
The IUPAC name of 2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine (CID 64812865) is 2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine.
What is the SMILES notation for 2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine?
The canonical SMILES for 2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine is NC1CCCC1c1nc2ccc(F)cc2[nH]1.
What is the InChIKey of 2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine?
The InChIKey is DRVWKWNJBKGKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3/c13-7-4-5-10-11(6-7)16-12(15-10)8-2-1-3-9(8)14/h4-6,8-9H,1-3,14H2,(H,15,16).
What are the key properties of 2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine?
2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine has a molecular weight of 219.26 g/mol, XLogP of 2.30, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 64812865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).