1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine

C13H17N3O2 — CID 43649844

IUPAC1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine
SMILESCOc1ccc(-c2cnc(C(C)N)[nH]2)c(OC)c1
InChIInChI=1S/C13H17N3O2/c1-8(14)13-15-7-11(16-13)10-5-4-9(17-2)6-12(10)18-3/h4-8H,14H2,1-3H3,(H,15,16)
InChIKeyYNCHHASXOQUVIT-UHFFFAOYSA-N
MW247.30 g/mol
LogP2.11
Rot. Bonds4

About 1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine

1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine (PubChem CID 43649844) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine.

Molecular Properties

Compound Name1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine
PubChem CID43649844
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine
SMILESCOc1ccc(-c2cnc(C(C)N)[nH]2)c(OC)c1
InChIInChI=1S/C13H17N3O2/c1-8(14)13-15-7-11(16-13)10-5-4-9(17-2)6-12(10)18-3/h4-8H,14H2,1-3H3,(H,15,16)
InChIKeyYNCHHASXOQUVIT-UHFFFAOYSA-N
XLogP2.11
TPSA73.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[5-(2,4-dimethoxyphenyl)-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-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]-N-methylethanamine
CID 95467419
1-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]ethanamine;dihydrochloride
CID 72716189
N-[2-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethyl]propan-2-amine
CID 60853832
N-[2-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethyl]cyclopropanamine
CID 60866079
2-[5-(2,5-dimethoxyphenyl)-1H-imidazol-2-yl]pentan-1-amine
CID 65233468
2-(2,4-dimethoxyphenyl)-5-methyl-1H-pyrrole
CID 82078942
2-(2,4-dimethoxyphenyl)-4,7-dimethoxy-1H-indole
CID 13011434
(1S)-1-[5-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl]ethanamine
CID 96599635
2-[5-(2,5-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine
CID 43650913
2-amino-2-[5-(2-methoxyphenyl)-1H-imidazol-2-yl]acetic acid
CID 116881506
1-[5-[4-(trifluoromethoxy)phenyl]-1H-imidazol-2-yl]ethanamine
CID 43649795
2-chloro-5-(2-methoxy-4-propan-2-ylphenyl)-1H-imidazole
CID 116884410

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine?
The IUPAC name of 1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine (CID 43649844) is 1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine.
What is the SMILES notation for 1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine?
The canonical SMILES for 1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine is COc1ccc(-c2cnc(C(C)N)[nH]2)c(OC)c1.
What is the InChIKey of 1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine?
The InChIKey is YNCHHASXOQUVIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-8(14)13-15-7-11(16-13)10-5-4-9(17-2)6-12(10)18-3/h4-8H,14H2,1-3H3,(H,15,16).
What are the key properties of 1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine?
1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine has a molecular weight of 247.30 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2,4-dimethoxyphenyl)-1H-imidazol-2-yl]ethanamine is sourced from PubChem (CID 43649844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).