1,3-diethyl-4-hydroxy-7-methylquinolin-2-one

C14H17NO2 — CID 54703297

IUPAC1,3-diethyl-4-hydroxy-7-methylquinolin-2-one
SMILESCCc1c(O)c2ccc(C)cc2n(CC)c1=O
InChIInChI=1S/C14H17NO2/c1-4-10-13(16)11-7-6-9(3)8-12(11)15(5-2)14(10)17/h6-8,16H,4-5H2,1-3H3
InChIKeyIRCUXEWKAVUTCB-UHFFFAOYSA-N
MW231.29 g/mol
LogP2.60
Rot. Bonds2

About 1,3-diethyl-4-hydroxy-7-methylquinolin-2-one

1,3-diethyl-4-hydroxy-7-methylquinolin-2-one (PubChem CID 54703297) has the molecular formula C14H17NO2 and a molecular weight of 231.29 g/mol. Its IUPAC name is 1,3-diethyl-4-hydroxy-7-methylquinolin-2-one.

Molecular Properties

Compound Name1,3-diethyl-4-hydroxy-7-methylquinolin-2-one
PubChem CID54703297
Molecular FormulaC14H17NO2
Molecular Weight231.29 g/mol
Exact Mass231.13
IUPAC Name1,3-diethyl-4-hydroxy-7-methylquinolin-2-one
SMILESCCc1c(O)c2ccc(C)cc2n(CC)c1=O
InChIInChI=1S/C14H17NO2/c1-4-10-13(16)11-7-6-9(3)8-12(11)15(5-2)14(10)17/h6-8,16H,4-5H2,1-3H3
InChIKeyIRCUXEWKAVUTCB-UHFFFAOYSA-N
XLogP2.60
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one
CID 54716845
9-ethyl-2-methylcarbazole
CID 19788789
3-ethyl-4-hydroxy-1-phenylquinolin-2-one
CID 54677985
1-ethyl-4-hydroxy-6-methylquinolin-2-one
CID 54696301
3-[(benzylamino)methyl]-1-ethyl-6-methylindole-2-carboxylic acid
CID 53208799
7-amino-1-ethyl-4-hydroxy-3-propan-2-yloxyquinolin-2-one
CID 54713859
1-ethyl-7-methyl-2-oxoquinoline-3-carbaldehyde
CID 18802182
1-ethyl-4-hydroxy-3-[C-methyl-N-(4-methylphenyl)carbonimidoyl]quinolin-2-one
CID 135473752
2-(3-chloro-4-ethyl-6-methyl-9-oxoacridin-10-yl)acetic acid;2-(5-ethyl-3-methyl-9-oxoacridin-10-yl)acetic acid
CID 164986153
1,3-diethyl-6-hydroxy-5-[(4-methylphenyl)diazenyl]pyrimidine-2,4-dione
CID 135672488
N-[1-ethyl-4-methyl-2-oxo-3-(2-oxopropyl)quinolin-7-yl]-2,2-dimethylpropanamide
CID 157238206
1,3-diethyl-2-(4-hydroxyphenyl)indol-6-ol
CID 13408386

Frequently Asked Questions

What is the IUPAC name of 1,3-diethyl-4-hydroxy-7-methylquinolin-2-one?
The IUPAC name of 1,3-diethyl-4-hydroxy-7-methylquinolin-2-one (CID 54703297) is 1,3-diethyl-4-hydroxy-7-methylquinolin-2-one.
What is the SMILES notation for 1,3-diethyl-4-hydroxy-7-methylquinolin-2-one?
The canonical SMILES for 1,3-diethyl-4-hydroxy-7-methylquinolin-2-one is CCc1c(O)c2ccc(C)cc2n(CC)c1=O.
What is the InChIKey of 1,3-diethyl-4-hydroxy-7-methylquinolin-2-one?
The InChIKey is IRCUXEWKAVUTCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-4-10-13(16)11-7-6-9(3)8-12(11)15(5-2)14(10)17/h6-8,16H,4-5H2,1-3H3.
What are the key properties of 1,3-diethyl-4-hydroxy-7-methylquinolin-2-one?
1,3-diethyl-4-hydroxy-7-methylquinolin-2-one has a molecular weight of 231.29 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diethyl-4-hydroxy-7-methylquinolin-2-one is sourced from PubChem (CID 54703297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).