4,7,8-trimethyl-3,4-dihydroquinoline

C12H15N — CID 138625490

IUPAC4,7,8-trimethyl-3,4-dihydroquinoline
SMILESCc1ccc2c(c1C)N=CCC2C
InChIInChI=1S/C12H15N/c1-8-4-5-11-9(2)6-7-13-12(11)10(8)3/h4-5,7,9H,6H2,1-3H3
InChIKeyYZGUMIHRQBIGQF-UHFFFAOYSA-N
MW173.26 g/mol
LogP3.51
Rot. Bonds

About 4,7,8-trimethyl-3,4-dihydroquinoline

4,7,8-trimethyl-3,4-dihydroquinoline (PubChem CID 138625490) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 4,7,8-trimethyl-3,4-dihydroquinoline.

Molecular Properties

Compound Name4,7,8-trimethyl-3,4-dihydroquinoline
PubChem CID138625490
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name4,7,8-trimethyl-3,4-dihydroquinoline
SMILESCc1ccc2c(c1C)N=CCC2C
InChIInChI=1S/C12H15N/c1-8-4-5-11-9(2)6-7-13-12(11)10(8)3/h4-5,7,9H,6H2,1-3H3
InChIKeyYZGUMIHRQBIGQF-UHFFFAOYSA-N
XLogP3.51
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,7,8-trimethyl-3,4-dihydroquinoline?
The IUPAC name of 4,7,8-trimethyl-3,4-dihydroquinoline (CID 138625490) is 4,7,8-trimethyl-3,4-dihydroquinoline.
What is the SMILES notation for 4,7,8-trimethyl-3,4-dihydroquinoline?
The canonical SMILES for 4,7,8-trimethyl-3,4-dihydroquinoline is Cc1ccc2c(c1C)N=CCC2C.
What is the InChIKey of 4,7,8-trimethyl-3,4-dihydroquinoline?
The InChIKey is YZGUMIHRQBIGQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-8-4-5-11-9(2)6-7-13-12(11)10(8)3/h4-5,7,9H,6H2,1-3H3.
What are the key properties of 4,7,8-trimethyl-3,4-dihydroquinoline?
4,7,8-trimethyl-3,4-dihydroquinoline has a molecular weight of 173.26 g/mol, XLogP of 3.51, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7,8-trimethyl-3,4-dihydroquinoline is sourced from PubChem (CID 138625490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).