6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one

C18H18N2O3 — CID 939236

IUPAC6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one
SMILESCOc1ccc2[nH]c(=O)c(CNc3ccccc3OC)cc2c1
InChIInChI=1S/C18H18N2O3/c1-22-14-7-8-15-12(10-14)9-13(18(21)20-15)11-19-16-5-3-4-6-17(16)23-2/h3-10,19H,11H2,1-2H3,(H,20,21)
InChIKeyAOPRRISLVAEQGE-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.16
Rot. Bonds5

About 6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one

6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one (PubChem CID 939236) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is 6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one
PubChem CID939236
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one
SMILESCOc1ccc2[nH]c(=O)c(CNc3ccccc3OC)cc2c1
InChIInChI=1S/C18H18N2O3/c1-22-14-7-8-15-12(10-14)9-13(18(21)20-15)11-19-16-5-3-4-6-17(16)23-2/h3-10,19H,11H2,1-2H3,(H,20,21)
InChIKeyAOPRRISLVAEQGE-UHFFFAOYSA-N
XLogP3.16
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Cilostamide
CID 2753
Haplamine
CID 648601
8-Methoxy-4-methylquinolin-2(1H)-one
CID 782123
2-Hydroxy-6-methoxy-4-methylquinoline
CID 220017
2-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino}-N,N-dimethylbenzamide
CID 10572854
N-(4-methoxyphenyl)-N-[(2-oxo-1H-quinolin-4-yl)methyl]propanamide
CID 862743
4-(((4-Methoxyphenyl)amino)methyl)quinolin-2-ol
CID 1850508
N-{2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl}benzamide
CID 13318464
4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1,2-dihydroquinoline-3-carboxamide
CID 54687734
N-(Cinnamoyl)-4-methoxyaniline
CID 690965
3-[(2,4-dimethylanilino)methyl]-6-methoxy-1H-quinolin-2-one
CID 941920
2(1H)-Quinolinone, 1-ethyl-6-methoxy-
CID 114297

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one?
The IUPAC name of 6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one (CID 939236) is 6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one.
What is the SMILES notation for 6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one?
The canonical SMILES for 6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one is COc1ccc2[nH]c(=O)c(CNc3ccccc3OC)cc2c1.
What is the InChIKey of 6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one?
The InChIKey is AOPRRISLVAEQGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-22-14-7-8-15-12(10-14)9-13(18(21)20-15)11-19-16-5-3-4-6-17(16)23-2/h3-10,19H,11H2,1-2H3,(H,20,21).
What are the key properties of 6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one?
6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one has a molecular weight of 310.35 g/mol, XLogP of 3.16, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3-[(2-methoxyanilino)methyl]-1H-quinolin-2-one is sourced from PubChem (CID 939236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).