4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine

C14H20N4O2 — CID 62506121

IUPAC4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine
SMILESCOc1ccc(-c2nc(C(C)C)n(N)c2N)cc1OC
InChIInChI=1S/C14H20N4O2/c1-8(2)14-17-12(13(15)18(14)16)9-5-6-10(19-3)11(7-9)20-4/h5-8H,15-16H2,1-4H3
InChIKeyDDAHEVGCDBORLT-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.99
Rot. Bonds4

About 4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine

4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine (PubChem CID 62506121) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine.

Molecular Properties

Compound Name4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine
PubChem CID62506121
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine
SMILESCOc1ccc(-c2nc(C(C)C)n(N)c2N)cc1OC
InChIInChI=1S/C14H20N4O2/c1-8(2)14-17-12(13(15)18(14)16)9-5-6-10(19-3)11(7-9)20-4/h5-8H,15-16H2,1-4H3
InChIKeyDDAHEVGCDBORLT-UHFFFAOYSA-N
XLogP1.99
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-(4-methylphenyl)-2-propan-2-ylimidazole-1,5-diamine
CID 62507931
2-cyclopropyl-4-(3,4-dimethoxyphenyl)imidazole-1,5-diamine
CID 62483620
4-(3-bromo-4-fluorophenyl)-2-propan-2-ylimidazole-1,5-diamine
CID 62508096
2-propan-2-yl-4-quinolin-6-ylimidazole-1,5-diamine
CID 63970356
4-[3-(difluoromethoxy)-4-methoxyphenyl]-2-ethylimidazole-1,5-diamine
CID 62483599
4,5,10,11,16,17-hexakis(3,4-dimethoxyphenyl)-3,6,9,12,15,18-hexazatetracyclo[12.4.0.02,7.08,13]octadeca-1,3,5,7,9,11,13,15,17-nonaene
CID 101071642
5-(3,4-dimethoxyphenyl)-3-methyl-2-propylimidazol-4-amine
CID 62220657
5-(3,4-dimethoxyphenyl)-3-(2-methylpropyl)imidazol-4-amine
CID 62019427
2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine;hydrochloride
CID 117068595
2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine
CID 65096454
4-(3-chloro-4-methoxyphenyl)-2-cyclopentylimidazole-1,5-diamine
CID 65022656
4-(2-methylphenyl)-2-propan-2-ylimidazole-1,5-diamine
CID 62506943

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine?
The IUPAC name of 4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine (CID 62506121) is 4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine.
What is the SMILES notation for 4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine?
The canonical SMILES for 4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine is COc1ccc(-c2nc(C(C)C)n(N)c2N)cc1OC.
What is the InChIKey of 4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine?
The InChIKey is DDAHEVGCDBORLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-8(2)14-17-12(13(15)18(14)16)9-5-6-10(19-3)11(7-9)20-4/h5-8H,15-16H2,1-4H3.
What are the key properties of 4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine?
4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine has a molecular weight of 276.34 g/mol, XLogP of 1.99, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine is sourced from PubChem (CID 62506121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).