3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine

C15H19N3 — CID 55048823

IUPAC3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine
SMILESCCc1nc(-c2ccc(C)cc2)c(N)n1C1CC1
InChIInChI=1S/C15H19N3/c1-3-13-17-14(11-6-4-10(2)5-7-11)15(16)18(13)12-8-9-12/h4-7,12H,3,8-9,16H2,1-2H3
InChIKeyLDQNWCLYFSDOMJ-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.34
Rot. Bonds3

About 3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine

3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine (PubChem CID 55048823) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine.

Molecular Properties

Compound Name3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine
PubChem CID55048823
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine
SMILESCCc1nc(-c2ccc(C)cc2)c(N)n1C1CC1
InChIInChI=1S/C15H19N3/c1-3-13-17-14(11-6-4-10(2)5-7-11)15(16)18(13)12-8-9-12/h4-7,12H,3,8-9,16H2,1-2H3
InChIKeyLDQNWCLYFSDOMJ-UHFFFAOYSA-N
XLogP3.34
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine?
The IUPAC name of 3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine (CID 55048823) is 3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine.
What is the SMILES notation for 3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine?
The canonical SMILES for 3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine is CCc1nc(-c2ccc(C)cc2)c(N)n1C1CC1.
What is the InChIKey of 3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine?
The InChIKey is LDQNWCLYFSDOMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-3-13-17-14(11-6-4-10(2)5-7-11)15(16)18(13)12-8-9-12/h4-7,12H,3,8-9,16H2,1-2H3.
What are the key properties of 3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine?
3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine has a molecular weight of 241.34 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine is sourced from PubChem (CID 55048823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).