1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine

C15H21N3O — CID 63970848

IUPAC1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine
SMILESCCn1ccnc1C(Cc1cccc(OC)c1)NC
InChIInChI=1S/C15H21N3O/c1-4-18-9-8-17-15(18)14(16-2)11-12-6-5-7-13(10-12)19-3/h5-10,14,16H,4,11H2,1-3H3
InChIKeyXBBNHPHMVWEFIG-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.41
Rot. Bonds6

About 1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine

1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine (PubChem CID 63970848) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine.

Molecular Properties

Compound Name1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine
PubChem CID63970848
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine
SMILESCCn1ccnc1C(Cc1cccc(OC)c1)NC
InChIInChI=1S/C15H21N3O/c1-4-18-9-8-17-15(18)14(16-2)11-12-6-5-7-13(10-12)19-3/h5-10,14,16H,4,11H2,1-3H3
InChIKeyXBBNHPHMVWEFIG-UHFFFAOYSA-N
XLogP2.41
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methoxyphenyl)-N-methyl-1-(1-methylimidazol-2-yl)ethanamine
CID 63974321
1-(1-ethylimidazol-2-yl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 115860096
2-(3-chlorophenyl)-N-ethyl-1-(1-ethylimidazol-2-yl)ethanamine
CID 63968122
N-[1-(1-ethylimidazol-2-yl)-2-(3-fluorophenyl)ethyl]propan-1-amine
CID 63970008
1-(2,6-difluorophenyl)-2-(3-methoxyphenyl)-N-methylethanamine
CID 61063803
2-(3-methoxyphenyl)-N-methyl-1-(4-propan-2-ylphenyl)ethanamine
CID 43625329
1-(3-chloro-4-pyridinyl)-2-(3-methoxyphenyl)-N-methylethanamine
CID 105133902
1-(3-methoxyphenyl)-N-methylbutan-2-amine
CID 61065553
N-[2-(3-methoxyphenyl)-1-pyrimidin-2-ylethyl]propan-1-amine
CID 62601372
N-ethyl-2-(3-methoxyphenyl)-1-pyridin-2-ylethanamine
CID 62600523
1-(4-bromo-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)-N-methylethanamine
CID 114648364
2-(3-methoxyphenyl)-N-methyl-1-(2-methylsulfanylphenyl)ethanamine
CID 79217018

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine?
The IUPAC name of 1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine (CID 63970848) is 1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine.
What is the SMILES notation for 1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine?
The canonical SMILES for 1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine is CCn1ccnc1C(Cc1cccc(OC)c1)NC.
What is the InChIKey of 1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine?
The InChIKey is XBBNHPHMVWEFIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-4-18-9-8-17-15(18)14(16-2)11-12-6-5-7-13(10-12)19-3/h5-10,14,16H,4,11H2,1-3H3.
What are the key properties of 1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine?
1-(1-ethylimidazol-2-yl)-2-(3-methoxyphenyl)-N-methylethanamine has a molecular weight of 259.35 g/mol, XLogP of 2.41, 6 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)-2-(3-methoxyphenyl)-N-methylethanamine is sourced from PubChem (CID 63970848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).