4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine

C14H20N4O2 — CID 62506594

IUPAC4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine
SMILESCCCc1nc(-c2cc(OC)ccc2OC)c(N)n1N
InChIInChI=1S/C14H20N4O2/c1-4-5-12-17-13(14(15)18(12)16)10-8-9(19-2)6-7-11(10)20-3/h6-8H,4-5,15-16H2,1-3H3
InChIKeyAFZNEGGFFJYPCD-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.82
Rot. Bonds5

About 4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine

4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine (PubChem CID 62506594) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine.

Molecular Properties

Compound Name4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine
PubChem CID62506594
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine
SMILESCCCc1nc(-c2cc(OC)ccc2OC)c(N)n1N
InChIInChI=1S/C14H20N4O2/c1-4-5-12-17-13(14(15)18(12)16)10-8-9(19-2)6-7-11(10)20-3/h6-8H,4-5,15-16H2,1-3H3
InChIKeyAFZNEGGFFJYPCD-UHFFFAOYSA-N
XLogP1.82
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine?
The IUPAC name of 4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine (CID 62506594) is 4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine.
What is the SMILES notation for 4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine?
The canonical SMILES for 4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine is CCCc1nc(-c2cc(OC)ccc2OC)c(N)n1N.
What is the InChIKey of 4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine?
The InChIKey is AFZNEGGFFJYPCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-4-5-12-17-13(14(15)18(12)16)10-8-9(19-2)6-7-11(10)20-3/h6-8H,4-5,15-16H2,1-3H3.
What are the key properties of 4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine?
4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine has a molecular weight of 276.34 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethoxyphenyl)-2-propylimidazole-1,5-diamine is sourced from PubChem (CID 62506594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).