3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine

C15H20N4 — CID 114720988

IUPAC3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine
SMILESCC1CCC(n2cncc2-c2cccnc2N)C1C
InChIInChI=1S/C15H20N4/c1-10-5-6-13(11(10)2)19-9-17-8-14(19)12-4-3-7-18-15(12)16/h3-4,7-11,13H,5-6H2,1-2H3,(H2,16,18)
InChIKeyXHIWLQLCDMZJHA-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.13
Rot. Bonds2

About 3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine

3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine (PubChem CID 114720988) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine.

Molecular Properties

Compound Name3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine
PubChem CID114720988
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine
SMILESCC1CCC(n2cncc2-c2cccnc2N)C1C
InChIInChI=1S/C15H20N4/c1-10-5-6-13(11(10)2)19-9-17-8-14(19)12-4-3-7-18-15(12)16/h3-4,7-11,13H,5-6H2,1-2H3,(H2,16,18)
InChIKeyXHIWLQLCDMZJHA-UHFFFAOYSA-N
XLogP3.13
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine?
The IUPAC name of 3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine (CID 114720988) is 3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine.
What is the SMILES notation for 3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine?
The canonical SMILES for 3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine is CC1CCC(n2cncc2-c2cccnc2N)C1C.
What is the InChIKey of 3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine?
The InChIKey is XHIWLQLCDMZJHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-10-5-6-13(11(10)2)19-9-17-8-14(19)12-4-3-7-18-15(12)16/h3-4,7-11,13H,5-6H2,1-2H3,(H2,16,18).
What are the key properties of 3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine?
3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2,3-dimethylcyclopentyl)imidazol-4-yl]pyridin-2-amine is sourced from PubChem (CID 114720988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).