2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine

C14H19N3O2 — CID 116834895

IUPAC2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine
SMILESCOc1cc(C)c(C(CN)c2ncc[nH]2)c(OC)c1
InChIInChI=1S/C14H19N3O2/c1-9-6-10(18-2)7-12(19-3)13(9)11(8-15)14-16-4-5-17-14/h4-7,11H,8,15H2,1-3H3,(H,16,17)
InChIKeyVETYYVJFCXQUHB-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.83
Rot. Bonds5

About 2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine

2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine (PubChem CID 116834895) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine.

Molecular Properties

Compound Name2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine
PubChem CID116834895
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine
SMILESCOc1cc(C)c(C(CN)c2ncc[nH]2)c(OC)c1
InChIInChI=1S/C14H19N3O2/c1-9-6-10(18-2)7-12(19-3)13(9)11(8-15)14-16-4-5-17-14/h4-7,11H,8,15H2,1-3H3,(H,16,17)
InChIKeyVETYYVJFCXQUHB-UHFFFAOYSA-N
XLogP1.83
TPSA73.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-bromo-2-methoxy-3,4,6-trimethylphenyl)-2-(1H-imidazol-2-yl)ethanamine
CID 116834918
2-amino-1-(2,4-dimethoxy-6-methylphenyl)ethanethiol
CID 116868681
2-(1H-imidazol-2-yl)-2-(2-methylphenyl)ethanamine
CID 116834897
1-(2,4-dimethoxy-6-methylphenyl)-1-N-methylbutane-1,3-diamine
CID 116948929
2-[bis(2,4-dimethoxy-6-methylphenyl)methyl]-1,3,5-trimethoxybenzene
CID 91355849
2-methyl-1-(2,4,6-trimethoxyphenyl)propane-1,3-diamine
CID 116933123
2-(1H-imidazol-2-yl)-2-(4-propan-2-ylphenyl)ethanamine
CID 116834796
(1S)-1-(2,4,6-trimethoxyphenyl)ethane-1,2-diamine;hydrochloride
CID 171201024
3-chloro-1-(2,4-dimethoxy-6-methylphenyl)propan-1-amine
CID 116937769
1-(2,4-dimethoxy-6-methylphenyl)-1-N-methylpentane-1,4-diamine
CID 116949911
1-(4-methoxy-2,6-dimethylphenyl)-3-methylbutan-1-amine
CID 82048906
2-chloro-1-(2,4-dimethoxy-6-methylphenyl)-N-methylethanamine
CID 116952676

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine?
The IUPAC name of 2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine (CID 116834895) is 2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine.
What is the SMILES notation for 2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine?
The canonical SMILES for 2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine is COc1cc(C)c(C(CN)c2ncc[nH]2)c(OC)c1.
What is the InChIKey of 2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine?
The InChIKey is VETYYVJFCXQUHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-9-6-10(18-2)7-12(19-3)13(9)11(8-15)14-16-4-5-17-14/h4-7,11H,8,15H2,1-3H3,(H,16,17).
What are the key properties of 2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine?
2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine has a molecular weight of 261.32 g/mol, XLogP of 1.83, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxy-6-methylphenyl)-2-(1H-imidazol-2-yl)ethanamine is sourced from PubChem (CID 116834895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).