8-methoxy-6-phenylmethoxy-1H-quinolin-4-one

C17H15NO3 — CID 15675252

IUPAC8-methoxy-6-phenylmethoxy-1H-quinolin-4-one
SMILESCOc1cc(OCc2ccccc2)cc2c(=O)cc[nH]c12
InChIInChI=1S/C17H15NO3/c1-20-16-10-13(21-11-12-5-3-2-4-6-12)9-14-15(19)7-8-18-17(14)16/h2-10H,11H2,1H3,(H,18,19)
InChIKeyBMDJVUIIRKKHSJ-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.12
Rot. Bonds4

About 8-methoxy-6-phenylmethoxy-1H-quinolin-4-one

8-methoxy-6-phenylmethoxy-1H-quinolin-4-one (PubChem CID 15675252) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is 8-methoxy-6-phenylmethoxy-1H-quinolin-4-one.

Molecular Properties

Compound Name8-methoxy-6-phenylmethoxy-1H-quinolin-4-one
PubChem CID15675252
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC Name8-methoxy-6-phenylmethoxy-1H-quinolin-4-one
SMILESCOc1cc(OCc2ccccc2)cc2c(=O)cc[nH]c12
InChIInChI=1S/C17H15NO3/c1-20-16-10-13(21-11-12-5-3-2-4-6-12)9-14-15(19)7-8-18-17(14)16/h2-10H,11H2,1H3,(H,18,19)
InChIKeyBMDJVUIIRKKHSJ-UHFFFAOYSA-N
XLogP3.12
TPSA51.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 8-methoxy-4-oxo-6-phenylmethoxy-1H-quinoline-3-carboxylate
CID 19914495
7-methyl-5-phenylmethoxy-1H-indole
CID 156694720
2-bromo-1,3-dimethoxy-5-phenylmethoxybenzene
CID 11186357
2-methoxy-4,6-bis(phenylmethoxy)benzaldehyde
CID 10980954
1-ethyl-2-methoxy-4-phenylmethoxybenzene
CID 130330824
2-acetyl-3-phenylmethoxy-1H-pyridin-4-one
CID 145314511
7-methoxy-5-phenylmethoxyindol-2-one
CID 123135354
CID 123516675
CID 123516675
2-hydroxy-6-methoxy-4-phenylmethoxybenzaldehyde
CID 90458250
3-phenylmethoxy-2-propanoyl-1H-pyridin-4-one
CID 159607116
4-bromo-5-methyl-7-phenylmethoxy-1H-indole
CID 59898831
benzyl N-(7-methoxy-4-oxo-1H-quinolin-6-yl)carbamate
CID 58931364

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-6-phenylmethoxy-1H-quinolin-4-one?
The IUPAC name of 8-methoxy-6-phenylmethoxy-1H-quinolin-4-one (CID 15675252) is 8-methoxy-6-phenylmethoxy-1H-quinolin-4-one.
What is the SMILES notation for 8-methoxy-6-phenylmethoxy-1H-quinolin-4-one?
The canonical SMILES for 8-methoxy-6-phenylmethoxy-1H-quinolin-4-one is COc1cc(OCc2ccccc2)cc2c(=O)cc[nH]c12.
What is the InChIKey of 8-methoxy-6-phenylmethoxy-1H-quinolin-4-one?
The InChIKey is BMDJVUIIRKKHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c1-20-16-10-13(21-11-12-5-3-2-4-6-12)9-14-15(19)7-8-18-17(14)16/h2-10H,11H2,1H3,(H,18,19).
What are the key properties of 8-methoxy-6-phenylmethoxy-1H-quinolin-4-one?
8-methoxy-6-phenylmethoxy-1H-quinolin-4-one has a molecular weight of 281.31 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-6-phenylmethoxy-1H-quinolin-4-one is sourced from PubChem (CID 15675252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).