2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine

C15H20N4O — CID 62498323

IUPAC2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine
SMILESCCCOc1cccc(-c2nc(C3CC3)n(N)c2N)c1
InChIInChI=1S/C15H20N4O/c1-2-8-20-12-5-3-4-11(9-12)13-14(16)19(17)15(18-13)10-6-7-10/h3-5,9-10H,2,6-8,16-17H2,1H3
InChIKeyAHRKWSHDUYXKEI-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.51
Rot. Bonds5

About 2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine

2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine (PubChem CID 62498323) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine.

Molecular Properties

Compound Name2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine
PubChem CID62498323
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine
SMILESCCCOc1cccc(-c2nc(C3CC3)n(N)c2N)c1
InChIInChI=1S/C15H20N4O/c1-2-8-20-12-5-3-4-11(9-12)13-14(16)19(17)15(18-13)10-6-7-10/h3-5,9-10H,2,6-8,16-17H2,1H3
InChIKeyAHRKWSHDUYXKEI-UHFFFAOYSA-N
XLogP2.51
TPSA79.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine 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 2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine?
The IUPAC name of 2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine (CID 62498323) is 2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine.
What is the SMILES notation for 2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine?
The canonical SMILES for 2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine is CCCOc1cccc(-c2nc(C3CC3)n(N)c2N)c1.
What is the InChIKey of 2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine?
The InChIKey is AHRKWSHDUYXKEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-2-8-20-12-5-3-4-11(9-12)13-14(16)19(17)15(18-13)10-6-7-10/h3-5,9-10H,2,6-8,16-17H2,1H3.
What are the key properties of 2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine?
2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine has a molecular weight of 272.35 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine is sourced from PubChem (CID 62498323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).