2-Methyl-1,2,5,6,7,8-hexahydroquinoline

C10H15N — CID 68201904

IUPAC2-methyl-1,2,5,6,7,8-hexahydroquinoline
SMILESCC1C=CC2=C(N1)CCCC2
InChIInChI=1S/C10H15N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h6-8,11H,2-5H2,1H3
InChIKeySDRQJAPYZYDOHW-UHFFFAOYSA-N
MW149.23 g/mol
LogP2.30
Rot. Bonds

About 2-Methyl-1,2,5,6,7,8-hexahydroquinoline

2-Methyl-1,2,5,6,7,8-hexahydroquinoline (PubChem CID 68201904) has the molecular formula C10H15N and a molecular weight of 149.23 g/mol. Its IUPAC name is 2-methyl-1,2,5,6,7,8-hexahydroquinoline.

Molecular Properties

Compound Name2-Methyl-1,2,5,6,7,8-hexahydroquinoline
PubChem CID68201904
Molecular FormulaC10H15N
Molecular Weight149.23 g/mol
Exact Mass149.12
IUPAC Name2-methyl-1,2,5,6,7,8-hexahydroquinoline
SMILESCC1C=CC2=C(N1)CCCC2
InChIInChI=1S/C10H15N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h6-8,11H,2-5H2,1H3
InChIKeySDRQJAPYZYDOHW-UHFFFAOYSA-N
XLogP2.30
TPSA12.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity213

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.23
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(Trifluoromethyl)-1,2,5,6,7,8-hexahydroquinoline
CID 134963478
2,6-Diallyl-4-vinyl-1,2,3,6-tetrahydro-pyridine
CID 3143282
5,6,7-Tetrahydroindole
CID 19835372
8-Hexahydroquinoline
CID 20226183
1,2,3,5-Tetrahydroquinoline
CID 20349835
Tetrahydro 2h phenanthridin
CID 21749136
10,13,14-Octahydrophenanthridine
CID 21863971
1,2,3,4,5,6-Hexahydroisoquinoline
CID 22152420
1,2,3,4,4a,5,10,10a-Octahydroacridine
CID 23065677
1,2,5,6,7,8-Hexahydroquinoline
CID 53784000
Decahydroacridine
CID 53901762
Tetrahydro--4-azabenz [f]indane-
CID 69354092

Frequently Asked Questions

What is the IUPAC name of 2-Methyl-1,2,5,6,7,8-hexahydroquinoline?
The IUPAC name of 2-Methyl-1,2,5,6,7,8-hexahydroquinoline (CID 68201904) is 2-methyl-1,2,5,6,7,8-hexahydroquinoline.
What is the SMILES notation for 2-Methyl-1,2,5,6,7,8-hexahydroquinoline?
The canonical SMILES for 2-Methyl-1,2,5,6,7,8-hexahydroquinoline is CC1C=CC2=C(N1)CCCC2.
What is the InChIKey of 2-Methyl-1,2,5,6,7,8-hexahydroquinoline?
The InChIKey is SDRQJAPYZYDOHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h6-8,11H,2-5H2,1H3.
What are the key properties of 2-Methyl-1,2,5,6,7,8-hexahydroquinoline?
2-Methyl-1,2,5,6,7,8-hexahydroquinoline has a molecular weight of 149.23 g/mol, XLogP of 2.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Methyl-1,2,5,6,7,8-hexahydroquinoline is sourced from PubChem (CID 68201904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).