1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one

C16H14N2O2 — CID 72919616

IUPAC1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one
SMILESCOc1ccnc(Cn2c(=O)ccc3ccccc32)c1
InChIInChI=1S/C16H14N2O2/c1-20-14-8-9-17-13(10-14)11-18-15-5-3-2-4-12(15)6-7-16(18)19/h2-10H,11H2,1H3
InChIKeyIWHXKMLHNRMIAP-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.45
Rot. Bonds3

About 1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one

1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one (PubChem CID 72919616) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one.

Molecular Properties

Compound Name1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one
PubChem CID72919616
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one
SMILESCOc1ccnc(Cn2c(=O)ccc3ccccc32)c1
InChIInChI=1S/C16H14N2O2/c1-20-14-8-9-17-13(10-14)11-18-15-5-3-2-4-12(15)6-7-16(18)19/h2-10H,11H2,1H3
InChIKeyIWHXKMLHNRMIAP-UHFFFAOYSA-N
XLogP2.45
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one?
The IUPAC name of 1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one (CID 72919616) is 1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one.
What is the SMILES notation for 1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one?
The canonical SMILES for 1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one is COc1ccnc(Cn2c(=O)ccc3ccccc32)c1.
What is the InChIKey of 1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one?
The InChIKey is IWHXKMLHNRMIAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-20-14-8-9-17-13(10-14)11-18-15-5-3-2-4-12(15)6-7-16(18)19/h2-10H,11H2,1H3.
What are the key properties of 1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one?
1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one has a molecular weight of 266.30 g/mol, XLogP of 2.45, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxy-2-pyridinyl)methyl]quinolin-2-one is sourced from PubChem (CID 72919616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).