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

C14H19N3 — CID 64814123

IUPAC2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine
SMILESCc1cc2nc(C3CCCC3N)[nH]c2cc1C
InChIInChI=1S/C14H19N3/c1-8-6-12-13(7-9(8)2)17-14(16-12)10-4-3-5-11(10)15/h6-7,10-11H,3-5,15H2,1-2H3,(H,16,17)
InChIKeyZFYTZCCOLQTNQL-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.77
Rot. Bonds1

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

2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine (PubChem CID 64814123) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine
PubChem CID64814123
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine
SMILESCc1cc2nc(C3CCCC3N)[nH]c2cc1C
InChIInChI=1S/C14H19N3/c1-8-6-12-13(7-9(8)2)17-14(16-12)10-4-3-5-11(10)15/h6-7,10-11H,3-5,15H2,1-2H3,(H,16,17)
InChIKeyZFYTZCCOLQTNQL-UHFFFAOYSA-N
XLogP2.77
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine?
The IUPAC name of 2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine (CID 64814123) is 2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine.
What is the SMILES notation for 2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine?
The canonical SMILES for 2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine is Cc1cc2nc(C3CCCC3N)[nH]c2cc1C.
What is the InChIKey of 2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine?
The InChIKey is ZFYTZCCOLQTNQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-8-6-12-13(7-9(8)2)17-14(16-12)10-4-3-5-11(10)15/h6-7,10-11H,3-5,15H2,1-2H3,(H,16,17).
What are the key properties of 2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine?
2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine has a molecular weight of 229.33 g/mol, XLogP of 2.77, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dimethyl-1H-benzimidazol-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 64814123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).