2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone

C16H15N3O — CID 105115236

IUPAC2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone
SMILESCCn1ccnc1CC(=O)c1cccc2ncccc12
InChIInChI=1S/C16H15N3O/c1-2-19-10-9-18-16(19)11-15(20)13-5-3-7-14-12(13)6-4-8-17-14/h3-10H,2,11H2,1H3
InChIKeyGZLNHXYWOVGXRO-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.88
Rot. Bonds4

About 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone

2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone (PubChem CID 105115236) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone
PubChem CID105115236
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone
SMILESCCn1ccnc1CC(=O)c1cccc2ncccc12
InChIInChI=1S/C16H15N3O/c1-2-19-10-9-18-16(19)11-15(20)13-5-3-7-14-12(13)6-4-8-17-14/h3-10H,2,11H2,1H3
InChIKeyGZLNHXYWOVGXRO-UHFFFAOYSA-N
XLogP2.88
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethyl-1,2,4-triazol-3-yl)-1-quinolin-5-ylethanone
CID 105111478
1-(2-bromo-3-methylphenyl)-2-(1-ethylimidazol-2-yl)ethanone
CID 107984553
1-quinolin-5-ylhexan-1-one
CID 115789824
1-(2,6-dichlorophenyl)-2-(1-ethylimidazol-2-yl)ethanone
CID 115783517
2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol
CID 105112369
2-(2-methylphenyl)-1-quinolin-5-ylethanone
CID 81220706
3,3,3-trifluoro-1-quinolin-5-ylpropan-1-one
CID 81220780
2-(4-aminophenyl)-1-quinolin-5-ylethanone
CID 116549569
2-tert-butylsulfanyl-1-quinolin-5-ylethanone
CID 81220116
1-(3-chlorophenyl)-2-(1-ethylimidazol-2-yl)ethanone
CID 79744909
3-methyl-1-quinolin-5-ylbut-3-en-1-one
CID 105112604
1-(2,3-dimethylphenyl)-2-(1-propylimidazol-2-yl)ethanone
CID 115784740

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone (CID 105115236) is 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone is CCn1ccnc1CC(=O)c1cccc2ncccc12.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone?
The InChIKey is GZLNHXYWOVGXRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-2-19-10-9-18-16(19)11-15(20)13-5-3-7-14-12(13)6-4-8-17-14/h3-10H,2,11H2,1H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone?
2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone has a molecular weight of 265.32 g/mol, XLogP of 2.88, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone is sourced from PubChem (CID 105115236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).