3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine

C15H21N3O3 — CID 62225022

IUPAC3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine
SMILESCCn1c(C)nc(-c2cc(OC)c(OC)c(OC)c2)c1N
InChIInChI=1S/C15H21N3O3/c1-6-18-9(2)17-13(15(18)16)10-7-11(19-3)14(21-5)12(8-10)20-4/h7-8H,6,16H2,1-5H3
InChIKeyGSICDFXBNIAQPU-UHFFFAOYSA-N
MW291.35 g/mol
LogP2.49
Rot. Bonds5

About 3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine

3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine (PubChem CID 62225022) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine.

Molecular Properties

Compound Name3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine
PubChem CID62225022
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine
SMILESCCn1c(C)nc(-c2cc(OC)c(OC)c(OC)c2)c1N
InChIInChI=1S/C15H21N3O3/c1-6-18-9(2)17-13(15(18)16)10-7-11(19-3)14(21-5)12(8-10)20-4/h7-8H,6,16H2,1-5H3
InChIKeyGSICDFXBNIAQPU-UHFFFAOYSA-N
XLogP2.49
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

9-butyl-8-(3,4,5-trimethoxybenzyl)-9H-purin-6-amine
CID 448965
Phenol, 4-[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]-2,6-dimethoxy-
CID 1842049
1-(4-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole
CID 11688687
2,4-Diamino-6-(3,4,5-trimethoxybenzyl)pyrimidine
CID 452507
2-Methoxy-5-[3-methyl-5-(3,4,5-trimethoxy-phenyl)-3H-imidazol-4-yl]-phenylamine
CID 9799457
2-Methoxy-5-[1-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-yl]aniline
CID 11728350
5-phenyl-2-[(3,4,5-trimethoxyphenyl)methyl]-1H-imidazole
CID 71717474
5-Phenyl-4-propyl-2-[(3,4,5-trimethoxyphenyl)methyl]-1H-imidazole
CID 71718679
4-(4,5-dimethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol
CID 154392110
2,6-dimethoxy-4-(4,5,6,7-tetrahydro-1H-benzimidazol-2-yl)phenol
CID 154667057
2,6-dimethoxy-4-(4-phenyl-5-propan-2-yl-1H-imidazol-2-yl)phenol
CID 154667070
4-(4,5-diethyl-1H-imidazol-2-yl)-2,6-dimethoxyphenol
CID 154667076

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine?
The IUPAC name of 3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine (CID 62225022) is 3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine.
What is the SMILES notation for 3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine?
The canonical SMILES for 3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine is CCn1c(C)nc(-c2cc(OC)c(OC)c(OC)c2)c1N.
What is the InChIKey of 3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine?
The InChIKey is GSICDFXBNIAQPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-6-18-9(2)17-13(15(18)16)10-7-11(19-3)14(21-5)12(8-10)20-4/h7-8H,6,16H2,1-5H3.
What are the key properties of 3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine?
3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine has a molecular weight of 291.35 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methyl-5-(3,4,5-trimethoxyphenyl)imidazol-4-amine is sourced from PubChem (CID 62225022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).