4-methoxyquinoline

C10H9NO — CID 521938

IUPAC4-methoxyquinoline
SMILESCOc1ccnc2ccccc12
InChIInChI=1S/C10H9NO/c1-12-10-6-7-11-9-5-3-2-4-8(9)10/h2-7H,1H3
InChIKeyRWTCJCUERNMVEZ-UHFFFAOYSA-N
MW159.19 g/mol
LogP2.24
Rot. Bonds1

About 4-methoxyquinoline

4-methoxyquinoline (PubChem CID 521938) has the molecular formula C10H9NO and a molecular weight of 159.19 g/mol. Its IUPAC name is 4-methoxyquinoline.

Molecular Properties

Compound Name4-methoxyquinoline
PubChem CID521938
Molecular FormulaC10H9NO
Molecular Weight159.19 g/mol
Exact Mass159.07
IUPAC Name4-methoxyquinoline
SMILESCOc1ccnc2ccccc12
InChIInChI=1S/C10H9NO/c1-12-10-6-7-11-9-5-3-2-4-8(9)10/h2-7H,1H3
InChIKeyRWTCJCUERNMVEZ-UHFFFAOYSA-N
XLogP2.24
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Primaquine
CID 4908
Quinocide
CID 68928
7-Hydroxyquinoline
CID 135426866
3-Hydroxyquinoline
CID 11376
Quinolin-5-ol
CID 135441757
6-Methoxy-8-quinolinamine
CID 7023
(+)-Primaquine
CID 3044369
6-Hydroxyquinoline
CID 11374
6-Methoxyquinoline
CID 14860
4-Methoxy-2-Phenylquinoline
CID 826247
Stannane, (8-quinolinolato)tributyl-
CID 16683764
6,7-Dimethoxy-1-methylisoquinoline
CID 20725

Frequently Asked Questions

What is the IUPAC name of 4-methoxyquinoline?
The IUPAC name of 4-methoxyquinoline (CID 521938) is 4-methoxyquinoline.
What is the SMILES notation for 4-methoxyquinoline?
The canonical SMILES for 4-methoxyquinoline is COc1ccnc2ccccc12.
What is the InChIKey of 4-methoxyquinoline?
The InChIKey is RWTCJCUERNMVEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO/c1-12-10-6-7-11-9-5-3-2-4-8(9)10/h2-7H,1H3.
What are the key properties of 4-methoxyquinoline?
4-methoxyquinoline has a molecular weight of 159.19 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxyquinoline is sourced from PubChem (CID 521938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).