1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine

C14H17N3O — CID 116883439

IUPAC1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine
SMILESCOc1ccc(-c2cnc(C3(N)CC3)[nH]2)cc1C
InChIInChI=1S/C14H17N3O/c1-9-7-10(3-4-12(9)18-2)11-8-16-13(17-11)14(15)5-6-14/h3-4,7-8H,5-6,15H2,1-2H3,(H,16,17)
InChIKeyHIXHQTOBCOITSI-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.34
Rot. Bonds3

About 1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine

1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine (PubChem CID 116883439) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine
PubChem CID116883439
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine
SMILESCOc1ccc(-c2cnc(C3(N)CC3)[nH]2)cc1C
InChIInChI=1S/C14H17N3O/c1-9-7-10(3-4-12(9)18-2)11-8-16-13(17-11)14(15)5-6-14/h3-4,7-8H,5-6,15H2,1-2H3,(H,16,17)
InChIKeyHIXHQTOBCOITSI-UHFFFAOYSA-N
XLogP2.34
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine 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

1-[5-(4-methoxy-3,5-dimethylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine
CID 116883486
1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclobutane-1-carbonitrile
CID 116882236
[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]methanamine
CID 82285154
2-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]propan-1-amine
CID 116876636
1-[5-(3-bromo-4-fluorophenyl)-1H-imidazol-2-yl]cyclopropan-1-amine
CID 65457295
4-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]piperidine
CID 95474427
2-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]-N-methylpropan-2-amine
CID 116879058
1-[5-(3,4-dimethylphenyl)-1H-imidazol-2-yl]cyclopropane-1-carbonitrile
CID 116881844
[1-[5-(3-bromo-4-methoxyphenyl)-1H-imidazol-2-yl]cyclopropyl]methanol
CID 116882019
4-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]butan-2-one
CID 116880882
[3-[5-(3,4-dimethylphenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanamine
CID 116882710
methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene
CID 161175155

Frequently Asked Questions

What is the IUPAC name of 1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine?
The IUPAC name of 1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine (CID 116883439) is 1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine.
What is the SMILES notation for 1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine?
The canonical SMILES for 1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine is COc1ccc(-c2cnc(C3(N)CC3)[nH]2)cc1C.
What is the InChIKey of 1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine?
The InChIKey is HIXHQTOBCOITSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-9-7-10(3-4-12(9)18-2)11-8-16-13(17-11)14(15)5-6-14/h3-4,7-8H,5-6,15H2,1-2H3,(H,16,17).
What are the key properties of 1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine?
1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine has a molecular weight of 243.31 g/mol, XLogP of 2.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(4-methoxy-3-methylphenyl)-1H-imidazol-2-yl]cyclopropan-1-amine is sourced from PubChem (CID 116883439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).