8-methyl-2,3,5,6,7,8-hexahydroquinoline

C10H15N — CID 167264804

IUPAC8-methyl-2,3,5,6,7,8-hexahydroquinoline
SMILESCC1CCCC2=CCCN=C21
InChIInChI=1S/C10H15N/c1-8-4-2-5-9-6-3-7-11-10(8)9/h6,8H,2-5,7H2,1H3
InChIKeyVTRGUZVTYRRTHJ-UHFFFAOYSA-N
MW149.24 g/mol
LogP2.58
Rot. Bonds

About 8-methyl-2,3,5,6,7,8-hexahydroquinoline

8-methyl-2,3,5,6,7,8-hexahydroquinoline (PubChem CID 167264804) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 8-methyl-2,3,5,6,7,8-hexahydroquinoline.

Molecular Properties

Compound Name8-methyl-2,3,5,6,7,8-hexahydroquinoline
PubChem CID167264804
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name8-methyl-2,3,5,6,7,8-hexahydroquinoline
SMILESCC1CCCC2=CCCN=C21
InChIInChI=1S/C10H15N/c1-8-4-2-5-9-6-3-7-11-10(8)9/h6,8H,2-5,7H2,1H3
InChIKeyVTRGUZVTYRRTHJ-UHFFFAOYSA-N
XLogP2.58
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-2,3,5,6,7,8-hexahydroquinoline?
The IUPAC name of 8-methyl-2,3,5,6,7,8-hexahydroquinoline (CID 167264804) is 8-methyl-2,3,5,6,7,8-hexahydroquinoline.
What is the SMILES notation for 8-methyl-2,3,5,6,7,8-hexahydroquinoline?
The canonical SMILES for 8-methyl-2,3,5,6,7,8-hexahydroquinoline is CC1CCCC2=CCCN=C21.
What is the InChIKey of 8-methyl-2,3,5,6,7,8-hexahydroquinoline?
The InChIKey is VTRGUZVTYRRTHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-8-4-2-5-9-6-3-7-11-10(8)9/h6,8H,2-5,7H2,1H3.
What are the key properties of 8-methyl-2,3,5,6,7,8-hexahydroquinoline?
8-methyl-2,3,5,6,7,8-hexahydroquinoline has a molecular weight of 149.24 g/mol, XLogP of 2.58, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2,3,5,6,7,8-hexahydroquinoline is sourced from PubChem (CID 167264804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).