2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine

C13H18N4 — CID 79751489

IUPAC2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine
SMILESCCn1ccnc1CC(N)c1ncccc1C
InChIInChI=1S/C13H18N4/c1-3-17-8-7-15-12(17)9-11(14)13-10(2)5-4-6-16-13/h4-8,11H,3,9,14H2,1-2H3
InChIKeyPTZSAONFTHWGGY-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.85
Rot. Bonds4

About 2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine

2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine (PubChem CID 79751489) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine
PubChem CID79751489
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine
SMILESCCn1ccnc1CC(N)c1ncccc1C
InChIInChI=1S/C13H18N4/c1-3-17-8-7-15-12(17)9-11(14)13-10(2)5-4-6-16-13/h4-8,11H,3,9,14H2,1-2H3
InChIKeyPTZSAONFTHWGGY-UHFFFAOYSA-N
XLogP1.85
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-ethylimidazol-2-yl)-1-(2-methylphenyl)ethanamine
CID 79751911
1-(3,5-dimethyl-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethanamine
CID 113365596
[1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 103445832
1-(2,5-dimethylphenyl)-2-(1-ethylimidazol-2-yl)ethanamine
CID 105009189
2-(1-ethylbenzimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine
CID 79756634
2-(1-ethylimidazol-2-yl)-1-(5-fluoro-2-methylphenyl)ethanamine
CID 79751964
(2R)-1-(1-ethylimidazol-2-yl)propan-2-amine
CID 92763393
2-(1-ethylimidazol-2-yl)-1-(4-methylquinolin-2-yl)ethanamine
CID 114755024
1-(2-tert-butylphenyl)-2-(1-ethylimidazol-2-yl)ethanamine
CID 105009550
(1R)-1-(3-methyl-2-pyridinyl)ethane-1,2-diamine
CID 55264530
(1S)-2-methoxy-1-(3-methyl-2-pyridinyl)ethanamine
CID 55293686
N-[1-(3-chloro-2-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]propan-1-amine
CID 103444803

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine (CID 79751489) is 2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine is CCn1ccnc1CC(N)c1ncccc1C.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine?
The InChIKey is PTZSAONFTHWGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-3-17-8-7-15-12(17)9-11(14)13-10(2)5-4-6-16-13/h4-8,11H,3,9,14H2,1-2H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine?
2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine has a molecular weight of 230.31 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)-1-(3-methyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 79751489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).