2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine

C12H16N4 — CID 106755605

IUPAC2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine
SMILESCc1cc(C(N)Cc2nccn2C)ccn1
InChIInChI=1S/C12H16N4/c1-9-7-10(3-4-14-9)11(13)8-12-15-5-6-16(12)2/h3-7,11H,8,13H2,1-2H3
InChIKeyLUBYKGWRFJINEY-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.37
Rot. Bonds3

About 2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine

2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine (PubChem CID 106755605) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine
PubChem CID106755605
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine
SMILESCc1cc(C(N)Cc2nccn2C)ccn1
InChIInChI=1S/C12H16N4/c1-9-7-10(3-4-14-9)11(13)8-12-15-5-6-16(12)2/h3-7,11H,8,13H2,1-2H3
InChIKeyLUBYKGWRFJINEY-UHFFFAOYSA-N
XLogP1.37
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-methoxy-4-methylphenyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 115580367
1-(3,5-dichlorophenyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 115580385
1-(4-chloro-3-fluorophenyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 107994332
1-(4-tert-butylphenyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 115580384
2-(1-methylimidazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethanamine
CID 112727320
1-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 171986196
2-(1-methylimidazol-2-yl)-1-(3-propoxyphenyl)ethanamine
CID 105011417
1-(2-methyl-4-pyridinyl)propan-1-amine
CID 55295377
2-amino-2-(2-methyl-4-pyridinyl)ethanol
CID 55292030
(2S)-2-amino-2-(2-methyl-4-pyridinyl)ethanol
CID 55264047
1-(5-bromo-2-methylphenyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 105011669
1-(2-bromo-5-methylphenyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 105011679

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine?
The IUPAC name of 2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine (CID 106755605) is 2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine.
What is the SMILES notation for 2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine?
The canonical SMILES for 2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine is Cc1cc(C(N)Cc2nccn2C)ccn1.
What is the InChIKey of 2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine?
The InChIKey is LUBYKGWRFJINEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-9-7-10(3-4-14-9)11(13)8-12-15-5-6-16(12)2/h3-7,11H,8,13H2,1-2H3.
What are the key properties of 2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine?
2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine has a molecular weight of 216.29 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine is sourced from PubChem (CID 106755605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).