7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline

C11H16N2O — CID 58095808

IUPAC7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline
SMILESCOc1ccc2c(c1)N(C)N(C)CC2
InChIInChI=1S/C11H16N2O/c1-12-7-6-9-4-5-10(14-3)8-11(9)13(12)2/h4-5,8H,6-7H2,1-3H3
InChIKeyOTHOZDDDCSUIMN-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.53
Rot. Bonds1

About 7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline

7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline (PubChem CID 58095808) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline.

Molecular Properties

Compound Name7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline
PubChem CID58095808
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline
SMILESCOc1ccc2c(c1)N(C)N(C)CC2
InChIInChI=1S/C11H16N2O/c1-12-7-6-9-4-5-10(14-3)8-11(9)13(12)2/h4-5,8H,6-7H2,1-3H3
InChIKeyOTHOZDDDCSUIMN-UHFFFAOYSA-N
XLogP1.53
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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1-[2-(6-methoxy-2,3-dihydroindol-1-yl)ethyl]cyclopropane-1-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline?
The IUPAC name of 7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline (CID 58095808) is 7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline.
What is the SMILES notation for 7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline?
The canonical SMILES for 7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline is COc1ccc2c(c1)N(C)N(C)CC2.
What is the InChIKey of 7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline?
The InChIKey is OTHOZDDDCSUIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-12-7-6-9-4-5-10(14-3)8-11(9)13(12)2/h4-5,8H,6-7H2,1-3H3.
What are the key properties of 7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline?
7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline has a molecular weight of 192.26 g/mol, XLogP of 1.53, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-1,2-dimethyl-3,4-dihydrocinnoline is sourced from PubChem (CID 58095808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).