2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine

C13H18N4O — CID 62483192

IUPAC2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine
SMILESCc1nc(-c2ccc(OC(C)C)cc2)c(N)n1N
InChIInChI=1S/C13H18N4O/c1-8(2)18-11-6-4-10(5-7-11)12-13(14)17(15)9(3)16-12/h4-8H,14-15H2,1-3H3
InChIKeyUHCSQSUSAVVBLX-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.94
Rot. Bonds3

About 2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine

2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine (PubChem CID 62483192) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine.

Molecular Properties

Compound Name2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine
PubChem CID62483192
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine
SMILESCc1nc(-c2ccc(OC(C)C)cc2)c(N)n1N
InChIInChI=1S/C13H18N4O/c1-8(2)18-11-6-4-10(5-7-11)12-13(14)17(15)9(3)16-12/h4-8H,14-15H2,1-3H3
InChIKeyUHCSQSUSAVVBLX-UHFFFAOYSA-N
XLogP1.94
TPSA79.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,3-dimethyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine
CID 55047871
2-methyl-5-(4-propan-2-yloxyphenyl)-3-prop-2-enylimidazol-4-amine
CID 62224890
4-[4-(difluoromethyl)phenyl]-2-methylimidazole-1,5-diamine
CID 113328558
3-methyl-6-(4-propan-2-yloxyphenyl)imidazo[2,1-b][1,3]thiazol-5-amine
CID 82068664
5-[4-(difluoromethoxy)phenyl]-2,3-dimethylimidazol-4-amine
CID 62225201
4-(4-methylphenyl)-2-propan-2-ylimidazole-1,5-diamine
CID 62507931
4-(3-fluoro-4-methylphenyl)-2-methylimidazole-1,5-diamine
CID 63645352
3,7-dimethyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-8-amine
CID 82059992
1-pentan-3-yl-3-(4-propan-2-yloxyphenyl)pyrazol-4-amine
CID 83203363
4-[4-(difluoromethoxy)-3-ethoxyphenyl]-2-methylimidazole-1,5-diamine
CID 62482978
3-cyclopropyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine
CID 62017174
4-(3,5-dichlorophenyl)-2-methylimidazole-1,5-diamine
CID 62483387

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine?
The IUPAC name of 2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine (CID 62483192) is 2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine.
What is the SMILES notation for 2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine?
The canonical SMILES for 2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine is Cc1nc(-c2ccc(OC(C)C)cc2)c(N)n1N.
What is the InChIKey of 2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine?
The InChIKey is UHCSQSUSAVVBLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-8(2)18-11-6-4-10(5-7-11)12-13(14)17(15)9(3)16-12/h4-8H,14-15H2,1-3H3.
What are the key properties of 2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine?
2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine has a molecular weight of 246.31 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(4-propan-2-yloxyphenyl)imidazole-1,5-diamine is sourced from PubChem (CID 62483192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).