4,6,7-trimethyl-3,4-dihydroquinoline

C12H15N — CID 138625489

IUPAC4,6,7-trimethyl-3,4-dihydroquinoline
SMILESCc1cc2c(cc1C)C(C)CC=N2
InChIInChI=1S/C12H15N/c1-8-4-5-13-12-7-10(3)9(2)6-11(8)12/h5-8H,4H2,1-3H3
InChIKeyJYOWXIPXMJUXNQ-UHFFFAOYSA-N
MW173.26 g/mol
LogP3.51
Rot. Bonds

About 4,6,7-trimethyl-3,4-dihydroquinoline

4,6,7-trimethyl-3,4-dihydroquinoline (PubChem CID 138625489) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 4,6,7-trimethyl-3,4-dihydroquinoline.

Molecular Properties

Compound Name4,6,7-trimethyl-3,4-dihydroquinoline
PubChem CID138625489
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name4,6,7-trimethyl-3,4-dihydroquinoline
SMILESCc1cc2c(cc1C)C(C)CC=N2
InChIInChI=1S/C12H15N/c1-8-4-5-13-12-7-10(3)9(2)6-11(8)12/h5-8H,4H2,1-3H3
InChIKeyJYOWXIPXMJUXNQ-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 4,6,7-trimethyl-3,4-dihydroquinoline?
The IUPAC name of 4,6,7-trimethyl-3,4-dihydroquinoline (CID 138625489) is 4,6,7-trimethyl-3,4-dihydroquinoline.
What is the SMILES notation for 4,6,7-trimethyl-3,4-dihydroquinoline?
The canonical SMILES for 4,6,7-trimethyl-3,4-dihydroquinoline is Cc1cc2c(cc1C)C(C)CC=N2.
What is the InChIKey of 4,6,7-trimethyl-3,4-dihydroquinoline?
The InChIKey is JYOWXIPXMJUXNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-8-4-5-13-12-7-10(3)9(2)6-11(8)12/h5-8H,4H2,1-3H3.
What are the key properties of 4,6,7-trimethyl-3,4-dihydroquinoline?
4,6,7-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 4,6,7-trimethyl-3,4-dihydroquinoline is sourced from PubChem (CID 138625489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).