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

C14H18N4O2 — CID 62483621

IUPAC2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine
SMILESCOc1ccc(-c2nc(C3CC3)n(N)c2N)c(OC)c1
InChIInChI=1S/C14H18N4O2/c1-19-9-5-6-10(11(7-9)20-2)12-13(15)18(16)14(17-12)8-3-4-8/h5-8H,3-4,15-16H2,1-2H3
InChIKeyBQTAZJYLBJTLCA-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.74
Rot. Bonds4

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

2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine (PubChem CID 62483621) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine.

Molecular Properties

Compound Name2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine
PubChem CID62483621
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine
SMILESCOc1ccc(-c2nc(C3CC3)n(N)c2N)c(OC)c1
InChIInChI=1S/C14H18N4O2/c1-19-9-5-6-10(11(7-9)20-2)12-13(15)18(16)14(17-12)8-3-4-8/h5-8H,3-4,15-16H2,1-2H3
InChIKeyBQTAZJYLBJTLCA-UHFFFAOYSA-N
XLogP1.74
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine?
The IUPAC name of 2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine (CID 62483621) is 2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine.
What is the SMILES notation for 2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine?
The canonical SMILES for 2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine is COc1ccc(-c2nc(C3CC3)n(N)c2N)c(OC)c1.
What is the InChIKey of 2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine?
The InChIKey is BQTAZJYLBJTLCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-19-9-5-6-10(11(7-9)20-2)12-13(15)18(16)14(17-12)8-3-4-8/h5-8H,3-4,15-16H2,1-2H3.
What are the key properties of 2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine?
2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine has a molecular weight of 274.32 g/mol, XLogP of 1.74, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-(2,4-dimethoxyphenyl)imidazole-1,5-diamine is sourced from PubChem (CID 62483621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).