5-methyl-3,4,6,7-tetrahydroquinoline

C10H13N — CID 143900748

IUPAC5-methyl-3,4,6,7-tetrahydroquinoline
SMILESCC1=C2CCC=NC2=CCC1
InChIInChI=1S/C10H13N/c1-8-4-2-6-10-9(8)5-3-7-11-10/h6-7H,2-5H2,1H3
InChIKeyVHAFIXXPTVTCMU-UHFFFAOYSA-N
MW147.22 g/mol
LogP2.85
Rot. Bonds

About 5-methyl-3,4,6,7-tetrahydroquinoline

5-methyl-3,4,6,7-tetrahydroquinoline (PubChem CID 143900748) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is 5-methyl-3,4,6,7-tetrahydroquinoline.

Molecular Properties

Compound Name5-methyl-3,4,6,7-tetrahydroquinoline
PubChem CID143900748
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name5-methyl-3,4,6,7-tetrahydroquinoline
SMILESCC1=C2CCC=NC2=CCC1
InChIInChI=1S/C10H13N/c1-8-4-2-6-10-9(8)5-3-7-11-10/h6-7H,2-5H2,1H3
InChIKeyVHAFIXXPTVTCMU-UHFFFAOYSA-N
XLogP2.85
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-methoxy-5-methyl-3,4-dihydropyridine
CID 89340727
6,7-dihydro-2H-cyclopenta[b]pyrazine
CID 123238167
1,5-dimethyl-1,2,3,4,6,7-hexahydronaphthalene
CID 171800450
1-methylcyclobutene;sulfane
CID 90109296
ethane;1-methylcyclobutene
CID 91484029
2,6-dimethylcyclohexa-1,5-dien-1-ol
CID 14982407
5,6-dimethylcyclohexa-1,5-dien-1-amine
CID 143080216
3,5,6,7-tetrahydroquinoline
CID 150974486
3-ethyl-5,6-dihydro-4H-indole
CID 10351840
(1E,5E)-1,5,9-trimethylcyclododeca-1,5,9-triene
CID 139597866
2,2,7-trimethyl-5,6-dihydro-3H-1-benzofuran
CID 143607654
8-methyl-2-propan-2-yl-1,2,3,4,6,7-hexahydronaphthalene
CID 177327707

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3,4,6,7-tetrahydroquinoline?
The IUPAC name of 5-methyl-3,4,6,7-tetrahydroquinoline (CID 143900748) is 5-methyl-3,4,6,7-tetrahydroquinoline.
What is the SMILES notation for 5-methyl-3,4,6,7-tetrahydroquinoline?
The canonical SMILES for 5-methyl-3,4,6,7-tetrahydroquinoline is CC1=C2CCC=NC2=CCC1.
What is the InChIKey of 5-methyl-3,4,6,7-tetrahydroquinoline?
The InChIKey is VHAFIXXPTVTCMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N/c1-8-4-2-6-10-9(8)5-3-7-11-10/h6-7H,2-5H2,1H3.
What are the key properties of 5-methyl-3,4,6,7-tetrahydroquinoline?
5-methyl-3,4,6,7-tetrahydroquinoline has a molecular weight of 147.22 g/mol, XLogP of 2.85, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3,4,6,7-tetrahydroquinoline is sourced from PubChem (CID 143900748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).