4,6-dimethoxycinnoline

C10H10N2O2 — CID 134989956

IUPAC4,6-dimethoxycinnoline
SMILESCOc1ccc2nncc(OC)c2c1
InChIInChI=1S/C10H10N2O2/c1-13-7-3-4-9-8(5-7)10(14-2)6-11-12-9/h3-6H,1-2H3
InChIKeyTVTHFCUWNKAMPT-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.65
Rot. Bonds2

About 4,6-dimethoxycinnoline

4,6-dimethoxycinnoline (PubChem CID 134989956) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 4,6-dimethoxycinnoline.

Molecular Properties

Compound Name4,6-dimethoxycinnoline
PubChem CID134989956
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name4,6-dimethoxycinnoline
SMILESCOc1ccc2nncc(OC)c2c1
InChIInChI=1S/C10H10N2O2/c1-13-7-3-4-9-8(5-7)10(14-2)6-11-12-9/h3-6H,1-2H3
InChIKeyTVTHFCUWNKAMPT-UHFFFAOYSA-N
XLogP1.65
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-fluoro-4-methoxycinnoline
CID 135395881
4-bromo-6-methoxycinnoline
CID 53415017
4-(2-bromo-4-methoxyphenoxy)cinnoline
CID 104707553
7-methoxy-4-propan-2-ylcinnoline
CID 164758055
1,7-dimethoxyphthalazine
CID 119093543
1-chloro-7-methoxyphthalazine
CID 15271578
5-methoxy-4-(4-methoxy-2-methylphenyl)-3-methylpyridazine
CID 118448819
ethane;O-(6-methoxyquinolin-4-yl)hydroxylamine
CID 157043543
6-methoxy-3-methyl-1,2,3-benzotriazin-4-one
CID 122431840
6-methoxyphthalazin-1-amine
CID 130119690
1,2,3,5-tetramethoxybenzene;1,2,4-trimethoxybenzene
CID 54271001
4,7-dimethoxyquinoline
CID 20743716

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethoxycinnoline?
The IUPAC name of 4,6-dimethoxycinnoline (CID 134989956) is 4,6-dimethoxycinnoline.
What is the SMILES notation for 4,6-dimethoxycinnoline?
The canonical SMILES for 4,6-dimethoxycinnoline is COc1ccc2nncc(OC)c2c1.
What is the InChIKey of 4,6-dimethoxycinnoline?
The InChIKey is TVTHFCUWNKAMPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-13-7-3-4-9-8(5-7)10(14-2)6-11-12-9/h3-6H,1-2H3.
What are the key properties of 4,6-dimethoxycinnoline?
4,6-dimethoxycinnoline has a molecular weight of 190.20 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxycinnoline is sourced from PubChem (CID 134989956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).