2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine

C18H21N3 — CID 62352149

IUPAC2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
SMILESCNC(Cn1cnc(C)c1C)c1ccc2ccccc2c1
InChIInChI=1S/C18H21N3/c1-13-14(2)21(12-20-13)11-18(19-3)17-9-8-15-6-4-5-7-16(15)10-17/h4-10,12,18-19H,11H2,1-3H3
InChIKeyLCPUAPOMCJDUCI-UHFFFAOYSA-N
MW279.39 g/mol
LogP3.61
Rot. Bonds4

About 2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine

2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine (PubChem CID 62352149) has the molecular formula C18H21N3 and a molecular weight of 279.39 g/mol. Its IUPAC name is 2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine.

Molecular Properties

Compound Name2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
PubChem CID62352149
Molecular FormulaC18H21N3
Molecular Weight279.39 g/mol
Exact Mass279.17
IUPAC Name2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
SMILESCNC(Cn1cnc(C)c1C)c1ccc2ccccc2c1
InChIInChI=1S/C18H21N3/c1-13-14(2)21(12-20-13)11-18(19-3)17-9-8-15-6-4-5-7-16(15)10-17/h4-10,12,18-19H,11H2,1-3H3
InChIKeyLCPUAPOMCJDUCI-UHFFFAOYSA-N
XLogP3.61
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine 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-(4,5-dimethylimidazol-1-yl)-1-(3,4-dimethylphenyl)-N-methylethanamine
CID 62349856
2-(4,5-dimethylimidazol-1-yl)-1-naphthalen-2-ylethanamine
CID 62350029
N-methyl-1-naphthalen-2-ylhexan-1-amine
CID 63416228
N-methyl-2-(2-methylphenyl)-1-naphthalen-2-ylethanamine
CID 63417370
3-(methylamino)-3-naphthalen-2-ylpropanenitrile
CID 116955229
2-(benzimidazol-1-yl)-1-(3-fluoro-4-methylphenyl)-N-methylethanamine
CID 107130065
3-ethoxy-N-methyl-1-naphthalen-2-ylpropan-1-amine
CID 112688302
2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
CID 63219539
N,3-dimethyl-1-naphthalen-2-ylpentan-1-amine
CID 62716073
1-(4,5-dimethylimidazol-1-yl)-N-methylpentan-2-amine
CID 62350364
N-methyl-1-naphthalen-2-yl-2-pyridin-3-ylethanamine
CID 62791095
2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
CID 103532164

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
The IUPAC name of 2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine (CID 62352149) is 2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine.
What is the SMILES notation for 2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
The canonical SMILES for 2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine is CNC(Cn1cnc(C)c1C)c1ccc2ccccc2c1.
What is the InChIKey of 2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
The InChIKey is LCPUAPOMCJDUCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3/c1-13-14(2)21(12-20-13)11-18(19-3)17-9-8-15-6-4-5-7-16(15)10-17/h4-10,12,18-19H,11H2,1-3H3.
What are the key properties of 2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine has a molecular weight of 279.39 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine is sourced from PubChem (CID 62352149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).