5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine

C15H21N3 — CID 62219048

IUPAC5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine
SMILESCCCc1nc(-c2ccc(C)cc2C)c(N)n1C
InChIInChI=1S/C15H21N3/c1-5-6-13-17-14(15(16)18(13)4)12-8-7-10(2)9-11(12)3/h7-9H,5-6,16H2,1-4H3
InChIKeyJAXJPEISVQIRCI-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.24
Rot. Bonds3

About 5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine

5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine (PubChem CID 62219048) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is 5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine.

Molecular Properties

Compound Name5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine
PubChem CID62219048
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine
SMILESCCCc1nc(-c2ccc(C)cc2C)c(N)n1C
InChIInChI=1S/C15H21N3/c1-5-6-13-17-14(15(16)18(13)4)12-8-7-10(2)9-11(12)3/h7-9H,5-6,16H2,1-4H3
InChIKeyJAXJPEISVQIRCI-UHFFFAOYSA-N
XLogP3.24
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine?
The IUPAC name of 5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine (CID 62219048) is 5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine.
What is the SMILES notation for 5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine?
The canonical SMILES for 5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine is CCCc1nc(-c2ccc(C)cc2C)c(N)n1C.
What is the InChIKey of 5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine?
The InChIKey is JAXJPEISVQIRCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-5-6-13-17-14(15(16)18(13)4)12-8-7-10(2)9-11(12)3/h7-9H,5-6,16H2,1-4H3.
What are the key properties of 5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine?
5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine has a molecular weight of 243.35 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine is sourced from PubChem (CID 62219048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).