3-ethyl-8-methyl-1H-quinolin-2-one

C12H13NO — CID 143939354

IUPAC3-ethyl-8-methyl-1H-quinolin-2-one
SMILESCCc1cc2cccc(C)c2[nH]c1=O
InChIInChI=1S/C12H13NO/c1-3-9-7-10-6-4-5-8(2)11(10)13-12(9)14/h4-7H,3H2,1-2H3,(H,13,14)
InChIKeyFUIKJQZOGUHIEN-UHFFFAOYSA-N
MW187.24 g/mol
LogP2.40
Rot. Bonds1

About 3-ethyl-8-methyl-1H-quinolin-2-one

3-ethyl-8-methyl-1H-quinolin-2-one (PubChem CID 143939354) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 3-ethyl-8-methyl-1H-quinolin-2-one.

Molecular Properties

Compound Name3-ethyl-8-methyl-1H-quinolin-2-one
PubChem CID143939354
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name3-ethyl-8-methyl-1H-quinolin-2-one
SMILESCCc1cc2cccc(C)c2[nH]c1=O
InChIInChI=1S/C12H13NO/c1-3-9-7-10-6-4-5-8(2)11(10)13-12(9)14/h4-7H,3H2,1-2H3,(H,13,14)
InChIKeyFUIKJQZOGUHIEN-UHFFFAOYSA-N
XLogP2.40
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(ethylaminomethyl)-8-methyl-1H-quinolin-2-one
CID 23009276
8-methyl-3-(methylaminomethyl)-1H-quinolin-2-one
CID 23009265
(8-methyl-2-oxo-1H-quinolin-3-yl)methyl-propan-2-ylazanium
CID 2066167
N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]pentanamide
CID 110324363
3-[[(2-fluorophenyl)methylamino]methyl]-8-methyl-1H-quinolin-2-one
CID 18525037
8-methyl-3-[[2-(2-methylphenyl)ethylamino]methyl]-1H-quinolin-2-one
CID 3176401
N-tert-butyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331121
N-tert-butyl-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 941828
3-[[2-(butylamino)phenyl]methyl]-8-methyl-1H-quinolin-2-one
CID 70399891
N-butyl-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 2022966
3-methoxy-8-methyl-1H-quinolin-2-one
CID 151998755
2,4,6-trimethyl-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 110324455

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-8-methyl-1H-quinolin-2-one?
The IUPAC name of 3-ethyl-8-methyl-1H-quinolin-2-one (CID 143939354) is 3-ethyl-8-methyl-1H-quinolin-2-one.
What is the SMILES notation for 3-ethyl-8-methyl-1H-quinolin-2-one?
The canonical SMILES for 3-ethyl-8-methyl-1H-quinolin-2-one is CCc1cc2cccc(C)c2[nH]c1=O.
What is the InChIKey of 3-ethyl-8-methyl-1H-quinolin-2-one?
The InChIKey is FUIKJQZOGUHIEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-3-9-7-10-6-4-5-8(2)11(10)13-12(9)14/h4-7H,3H2,1-2H3,(H,13,14).
What are the key properties of 3-ethyl-8-methyl-1H-quinolin-2-one?
3-ethyl-8-methyl-1H-quinolin-2-one has a molecular weight of 187.24 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-8-methyl-1H-quinolin-2-one is sourced from PubChem (CID 143939354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).