N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine

C13H21N3 — CID 106575615

IUPACN-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine
SMILESCC1CCC(n2ccnc2NC2CC2)C1C
InChIInChI=1S/C13H21N3/c1-9-3-6-12(10(9)2)16-8-7-14-13(16)15-11-4-5-11/h7-12H,3-6H2,1-2H3,(H,14,15)
InChIKeyOCGVLCRSNYRXKM-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.06
Rot. Bonds3

About N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine

N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine (PubChem CID 106575615) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine
PubChem CID106575615
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC NameN-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine
SMILESCC1CCC(n2ccnc2NC2CC2)C1C
InChIInChI=1S/C13H21N3/c1-9-3-6-12(10(9)2)16-8-7-14-13(16)15-11-4-5-11/h7-12H,3-6H2,1-2H3,(H,14,15)
InChIKeyOCGVLCRSNYRXKM-UHFFFAOYSA-N
XLogP3.06
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine?
The IUPAC name of N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine (CID 106575615) is N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine.
What is the SMILES notation for N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine?
The canonical SMILES for N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine is CC1CCC(n2ccnc2NC2CC2)C1C.
What is the InChIKey of N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine?
The InChIKey is OCGVLCRSNYRXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-9-3-6-12(10(9)2)16-8-7-14-13(16)15-11-4-5-11/h7-12H,3-6H2,1-2H3,(H,14,15).
What are the key properties of N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine?
N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine has a molecular weight of 219.33 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(2,3-dimethylcyclopentyl)imidazol-2-amine is sourced from PubChem (CID 106575615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).