6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine

C9H15N — CID 123939563

IUPAC6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine
SMILESC=CCC1CCCN=C1C
InChIInChI=1S/C9H15N/c1-3-5-9-6-4-7-10-8(9)2/h3,9H,1,4-7H2,2H3
InChIKeyLQFZAVWZCPRAEO-UHFFFAOYSA-N
MW137.23 g/mol
LogP2.43
Rot. Bonds2

About 6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine

6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine (PubChem CID 123939563) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine.

Molecular Properties

Compound Name6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine
PubChem CID123939563
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine
SMILESC=CCC1CCCN=C1C
InChIInChI=1S/C9H15N/c1-3-5-9-6-4-7-10-8(9)2/h3,9H,1,4-7H2,2H3
InChIKeyLQFZAVWZCPRAEO-UHFFFAOYSA-N
XLogP2.43
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-Methyl-2-allyl-2,3,4,5-tetrahydropyridine
CID 129798488
5-hept-1-en-4-yl-3,4-dihydro-2H-pyrrole
CID 134864048
3,4,4a,5-tetrahydro-2H-cyclopenta[b]pyridine
CID 164669517
2-Propan-2-yl-3,4-dihydropyridine
CID 14979254
3,3a,4,5-tetrahydro-2H-indole
CID 53636670
3,3a,4,7-tetrahydro-2H-indole
CID 54297230
2,3,4,4a,5,8-Hexahydroquinoline
CID 57072516
3,3a,6,7-tetrahydro-2H-indole
CID 57133551
3,4,5,5a,6,9-hexahydro-2H-1-benzazepine
CID 57190739
4,5,5,6-tetrakis(prop-2-enyl)-3,4-dihydro-2H-pyridine
CID 69327479
(4S)-2-ethyl-4-methyl-3,4-dihydropyridine
CID 89163833
N-pentyl-2-prop-2-enylcyclohexan-1-imine
CID 121391547

Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine?
The IUPAC name of 6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine (CID 123939563) is 6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine.
What is the SMILES notation for 6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine?
The canonical SMILES for 6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine is C=CCC1CCCN=C1C.
What is the InChIKey of 6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine?
The InChIKey is LQFZAVWZCPRAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-3-5-9-6-4-7-10-8(9)2/h3,9H,1,4-7H2,2H3.
What are the key properties of 6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine?
6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine has a molecular weight of 137.23 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-prop-2-enyl-2,3,4,5-tetrahydropyridine is sourced from PubChem (CID 123939563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).