1,2,6-trimethyl-3,4-dihydrocinnoline

C11H16N2 — CID 58095805

IUPAC1,2,6-trimethyl-3,4-dihydrocinnoline
SMILESCc1ccc2c(c1)CCN(C)N2C
InChIInChI=1S/C11H16N2/c1-9-4-5-11-10(8-9)6-7-12(2)13(11)3/h4-5,8H,6-7H2,1-3H3
InChIKeyIRIIVZCHACYZQW-UHFFFAOYSA-N
MW176.26 g/mol
LogP1.83
Rot. Bonds

About 1,2,6-trimethyl-3,4-dihydrocinnoline

1,2,6-trimethyl-3,4-dihydrocinnoline (PubChem CID 58095805) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 1,2,6-trimethyl-3,4-dihydrocinnoline.

Molecular Properties

Compound Name1,2,6-trimethyl-3,4-dihydrocinnoline
PubChem CID58095805
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name1,2,6-trimethyl-3,4-dihydrocinnoline
SMILESCc1ccc2c(c1)CCN(C)N2C
InChIInChI=1S/C11H16N2/c1-9-4-5-11-10(8-9)6-7-12(2)13(11)3/h4-5,8H,6-7H2,1-3H3
InChIKeyIRIIVZCHACYZQW-UHFFFAOYSA-N
XLogP1.83
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2,6-trimethyl-3,4-dihydrocinnoline?
The IUPAC name of 1,2,6-trimethyl-3,4-dihydrocinnoline (CID 58095805) is 1,2,6-trimethyl-3,4-dihydrocinnoline.
What is the SMILES notation for 1,2,6-trimethyl-3,4-dihydrocinnoline?
The canonical SMILES for 1,2,6-trimethyl-3,4-dihydrocinnoline is Cc1ccc2c(c1)CCN(C)N2C.
What is the InChIKey of 1,2,6-trimethyl-3,4-dihydrocinnoline?
The InChIKey is IRIIVZCHACYZQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-9-4-5-11-10(8-9)6-7-12(2)13(11)3/h4-5,8H,6-7H2,1-3H3.
What are the key properties of 1,2,6-trimethyl-3,4-dihydrocinnoline?
1,2,6-trimethyl-3,4-dihydrocinnoline has a molecular weight of 176.26 g/mol, XLogP of 1.83, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,6-trimethyl-3,4-dihydrocinnoline is sourced from PubChem (CID 58095805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).