1-cyclopropyl-5-phenylimidazol-2-amine

C12H13N3 — CID 53316792

IUPAC1-cyclopropyl-5-phenylimidazol-2-amine
SMILESNc1ncc(-c2ccccc2)n1C1CC1
InChIInChI=1S/C12H13N3/c13-12-14-8-11(15(12)10-6-7-10)9-4-2-1-3-5-9/h1-5,8,10H,6-7H2,(H2,13,14)
InChIKeyTVEWLQKQZJCCPB-UHFFFAOYSA-N
MW199.26 g/mol
LogP2.47
Rot. Bonds2

About 1-cyclopropyl-5-phenylimidazol-2-amine

1-cyclopropyl-5-phenylimidazol-2-amine (PubChem CID 53316792) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is 1-cyclopropyl-5-phenylimidazol-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-5-phenylimidazol-2-amine
PubChem CID53316792
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC Name1-cyclopropyl-5-phenylimidazol-2-amine
SMILESNc1ncc(-c2ccccc2)n1C1CC1
InChIInChI=1S/C12H13N3/c13-12-14-8-11(15(12)10-6-7-10)9-4-2-1-3-5-9/h1-5,8,10H,6-7H2,(H2,13,14)
InChIKeyTVEWLQKQZJCCPB-UHFFFAOYSA-N
XLogP2.47
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-5-phenylimidazol-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 1-cyclopropyl-5-phenylimidazol-2-amine?
The IUPAC name of 1-cyclopropyl-5-phenylimidazol-2-amine (CID 53316792) is 1-cyclopropyl-5-phenylimidazol-2-amine.
What is the SMILES notation for 1-cyclopropyl-5-phenylimidazol-2-amine?
The canonical SMILES for 1-cyclopropyl-5-phenylimidazol-2-amine is Nc1ncc(-c2ccccc2)n1C1CC1.
What is the InChIKey of 1-cyclopropyl-5-phenylimidazol-2-amine?
The InChIKey is TVEWLQKQZJCCPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c13-12-14-8-11(15(12)10-6-7-10)9-4-2-1-3-5-9/h1-5,8,10H,6-7H2,(H2,13,14).
What are the key properties of 1-cyclopropyl-5-phenylimidazol-2-amine?
1-cyclopropyl-5-phenylimidazol-2-amine has a molecular weight of 199.26 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-5-phenylimidazol-2-amine is sourced from PubChem (CID 53316792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).