7,8-dimethyl-6,7-dihydroquinoline

C11H13N — CID 89495225

IUPAC7,8-dimethyl-6,7-dihydroquinoline
SMILESCC1=c2ncccc2=CCC1C
InChIInChI=1S/C11H13N/c1-8-5-6-10-4-3-7-12-11(10)9(8)2/h3-4,6-8H,5H2,1-2H3
InChIKeyYTDLMTYFVBFSIJ-UHFFFAOYSA-N
MW159.23 g/mol
LogP1.07
Rot. Bonds

About 7,8-dimethyl-6,7-dihydroquinoline

7,8-dimethyl-6,7-dihydroquinoline (PubChem CID 89495225) has the molecular formula C11H13N and a molecular weight of 159.23 g/mol. Its IUPAC name is 7,8-dimethyl-6,7-dihydroquinoline.

Molecular Properties

Compound Name7,8-dimethyl-6,7-dihydroquinoline
PubChem CID89495225
Molecular FormulaC11H13N
Molecular Weight159.23 g/mol
Exact Mass159.10
IUPAC Name7,8-dimethyl-6,7-dihydroquinoline
SMILESCC1=c2ncccc2=CCC1C
InChIInChI=1S/C11H13N/c1-8-5-6-10-4-3-7-12-11(10)9(8)2/h3-4,6-8H,5H2,1-2H3
InChIKeyYTDLMTYFVBFSIJ-UHFFFAOYSA-N
XLogP1.07
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7,8-dimethyl-6,7-dihydroquinoline?
The IUPAC name of 7,8-dimethyl-6,7-dihydroquinoline (CID 89495225) is 7,8-dimethyl-6,7-dihydroquinoline.
What is the SMILES notation for 7,8-dimethyl-6,7-dihydroquinoline?
The canonical SMILES for 7,8-dimethyl-6,7-dihydroquinoline is CC1=c2ncccc2=CCC1C.
What is the InChIKey of 7,8-dimethyl-6,7-dihydroquinoline?
The InChIKey is YTDLMTYFVBFSIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N/c1-8-5-6-10-4-3-7-12-11(10)9(8)2/h3-4,6-8H,5H2,1-2H3.
What are the key properties of 7,8-dimethyl-6,7-dihydroquinoline?
7,8-dimethyl-6,7-dihydroquinoline has a molecular weight of 159.23 g/mol, XLogP of 1.07, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dimethyl-6,7-dihydroquinoline is sourced from PubChem (CID 89495225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).