2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine

C15H20N4 — CID 55080057

IUPAC2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine
SMILESCC(Cc1nc(C2CC2)n(N)c1N)c1ccccc1
InChIInChI=1S/C15H20N4/c1-10(11-5-3-2-4-6-11)9-13-14(16)19(17)15(18-13)12-7-8-12/h2-6,10,12H,7-9,16-17H2,1H3
InChIKeyKUJJWODDRVIRLL-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.40
Rot. Bonds4

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

2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine (PubChem CID 55080057) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine.

Molecular Properties

Compound Name2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine
PubChem CID55080057
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine
SMILESCC(Cc1nc(C2CC2)n(N)c1N)c1ccccc1
InChIInChI=1S/C15H20N4/c1-10(11-5-3-2-4-6-11)9-13-14(16)19(17)15(18-13)12-7-8-12/h2-6,10,12H,7-9,16-17H2,1H3
InChIKeyKUJJWODDRVIRLL-UHFFFAOYSA-N
XLogP2.40
TPSA69.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine?
The IUPAC name of 2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine (CID 55080057) is 2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine.
What is the SMILES notation for 2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine?
The canonical SMILES for 2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine is CC(Cc1nc(C2CC2)n(N)c1N)c1ccccc1.
What is the InChIKey of 2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine?
The InChIKey is KUJJWODDRVIRLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-10(11-5-3-2-4-6-11)9-13-14(16)19(17)15(18-13)12-7-8-12/h2-6,10,12H,7-9,16-17H2,1H3.
What are the key properties of 2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine?
2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine has a molecular weight of 256.35 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-(2-phenylpropyl)imidazole-1,5-diamine is sourced from PubChem (CID 55080057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).