1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine

C16H23N3O — CID 115860096

IUPAC1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
SMILESCCn1ccnc1C(CCc1ccc(OC)cc1)NC
InChIInChI=1S/C16H23N3O/c1-4-19-12-11-18-16(19)15(17-2)10-7-13-5-8-14(20-3)9-6-13/h5-6,8-9,11-12,15,17H,4,7,10H2,1-3H3
InChIKeyKCZCCWWSGWUMNS-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.80
Rot. Bonds7

About 1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine

1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine (PubChem CID 115860096) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
PubChem CID115860096
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
SMILESCCn1ccnc1C(CCc1ccc(OC)cc1)NC
InChIInChI=1S/C16H23N3O/c1-4-19-12-11-18-16(19)15(17-2)10-7-13-5-8-14(20-3)9-6-13/h5-6,8-9,11-12,15,17H,4,7,10H2,1-3H3
InChIKeyKCZCCWWSGWUMNS-UHFFFAOYSA-N
XLogP2.80
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-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-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine
CID 63970848
1-(3-ethyl-2-pyridinyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 82732475
3-(4-methoxyphenyl)-N-methyl-1-pyrazin-2-ylpropan-1-amine
CID 65446084
N-[(1-ethylimidazol-2-yl)methyl]-2-(4-methoxyphenyl)ethanamine
CID 46784377
N',N'-diethyl-1-(1-ethylimidazol-2-yl)-N-methylpropane-1,3-diamine
CID 79087528
3-(4-methoxyphenyl)-N-methyl-1-(3-methyltriazol-4-yl)propan-1-amine
CID 105043353
1-(3,5-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 115796419
1-(2-chlorophenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 65446090
1-(1-ethylimidazol-2-yl)-N-methyl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103215345
2-cycloheptyl-1-(1-ethylimidazol-2-yl)-N-methylethanamine
CID 115860135
3-(4-methoxyphenyl)-N-methyl-1-(5-methylthiophen-2-yl)propan-1-amine
CID 43480428
1-(2-iodophenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 115864663

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
The IUPAC name of 1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine (CID 115860096) is 1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine.
What is the SMILES notation for 1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
The canonical SMILES for 1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine is CCn1ccnc1C(CCc1ccc(OC)cc1)NC.
What is the InChIKey of 1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
The InChIKey is KCZCCWWSGWUMNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-4-19-12-11-18-16(19)15(17-2)10-7-13-5-8-14(20-3)9-6-13/h5-6,8-9,11-12,15,17H,4,7,10H2,1-3H3.
What are the key properties of 1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine has a molecular weight of 273.38 g/mol, XLogP of 2.80, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine is sourced from PubChem (CID 115860096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).