4-methoxy-8-methylcinnoline

C10H10N2O — CID 134914583

IUPAC4-methoxy-8-methylcinnoline
SMILESCOc1cnnc2c(C)cccc12
InChIInChI=1S/C10H10N2O/c1-7-4-3-5-8-9(13-2)6-11-12-10(7)8/h3-6H,1-2H3
InChIKeyKIQJDLPQYRJFKG-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.95
Rot. Bonds1

About 4-methoxy-8-methylcinnoline

4-methoxy-8-methylcinnoline (PubChem CID 134914583) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 4-methoxy-8-methylcinnoline.

Molecular Properties

Compound Name4-methoxy-8-methylcinnoline
PubChem CID134914583
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name4-methoxy-8-methylcinnoline
SMILESCOc1cnnc2c(C)cccc12
InChIInChI=1S/C10H10N2O/c1-7-4-3-5-8-9(13-2)6-11-12-10(7)8/h3-6H,1-2H3
InChIKeyKIQJDLPQYRJFKG-UHFFFAOYSA-N
XLogP1.95
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-Cinnolinyl methyl ether
CID 292501
4-[(Z)-2-(2-methoxyphenyl)ethenyl]cinnoline
CID 54602268
8-(4-Methoxyphenyl)-4-[4-(trifluoromethyl)phenyl]cinnoline
CID 15891216
4-(4-Methoxyphenyl)-8-[4-(trifluoromethyl)phenyl]cinnoline
CID 15891218
5-Fluoro-4-prop-2-ynoxycinnoline
CID 177851022
4-(Cinnolin-4-yloxymethyl)benzonitrile
CID 8098224
4-Prop-2-enoxycinnoline
CID 135060412
4-Chloro-8-methoxycinnoline
CID 17750100
4-Phenoxycinnoline
CID 21991035
CID 22011896
CID 22011896
7-Methoxycinnoline
CID 67104040
6-Methoxycinnoline
CID 85873371

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-8-methylcinnoline?
The IUPAC name of 4-methoxy-8-methylcinnoline (CID 134914583) is 4-methoxy-8-methylcinnoline.
What is the SMILES notation for 4-methoxy-8-methylcinnoline?
The canonical SMILES for 4-methoxy-8-methylcinnoline is COc1cnnc2c(C)cccc12.
What is the InChIKey of 4-methoxy-8-methylcinnoline?
The InChIKey is KIQJDLPQYRJFKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-7-4-3-5-8-9(13-2)6-11-12-10(7)8/h3-6H,1-2H3.
What are the key properties of 4-methoxy-8-methylcinnoline?
4-methoxy-8-methylcinnoline has a molecular weight of 174.20 g/mol, XLogP of 1.95, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-8-methylcinnoline is sourced from PubChem (CID 134914583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).