2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine

C15H20N4 — CID 43734409

IUPAC2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine
SMILESCC(NC1CCCC1n1ccnc1)c1cccnc1
InChIInChI=1S/C15H20N4/c1-12(13-4-3-7-16-10-13)18-14-5-2-6-15(14)19-9-8-17-11-19/h3-4,7-12,14-15,18H,2,5-6H2,1H3
InChIKeyJNZUVXPOOJEHAS-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.72
Rot. Bonds4

About 2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine

2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine (PubChem CID 43734409) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine
PubChem CID43734409
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine
SMILESCC(NC1CCCC1n1ccnc1)c1cccnc1
InChIInChI=1S/C15H20N4/c1-12(13-4-3-7-16-10-13)18-14-5-2-6-15(14)19-9-8-17-11-19/h3-4,7-12,14-15,18H,2,5-6H2,1H3
InChIKeyJNZUVXPOOJEHAS-UHFFFAOYSA-N
XLogP2.72
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine?
The IUPAC name of 2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine (CID 43734409) is 2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine.
What is the SMILES notation for 2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine?
The canonical SMILES for 2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine is CC(NC1CCCC1n1ccnc1)c1cccnc1.
What is the InChIKey of 2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine?
The InChIKey is JNZUVXPOOJEHAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-12(13-4-3-7-16-10-13)18-14-5-2-6-15(14)19-9-8-17-11-19/h3-4,7-12,14-15,18H,2,5-6H2,1H3.
What are the key properties of 2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine?
2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine has a molecular weight of 256.35 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-N-(1-pyridin-3-ylethyl)cyclopentan-1-amine is sourced from PubChem (CID 43734409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).