4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine

C10H17N — CID 123480536

IUPAC4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine
SMILESC=CC(CC)C1=CCNCC1
InChIInChI=1S/C10H17N/c1-3-9(4-2)10-5-7-11-8-6-10/h3,5,9,11H,1,4,6-8H2,2H3
InChIKeyWMPGQIGYOFISMT-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.12
Rot. Bonds3

About 4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine

4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine (PubChem CID 123480536) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine.

Molecular Properties

Compound Name4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine
PubChem CID123480536
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine
SMILESC=CC(CC)C1=CCNCC1
InChIInChI=1S/C10H17N/c1-3-9(4-2)10-5-7-11-8-6-10/h3,5,9,11H,1,4,6-8H2,2H3
InChIKeyWMPGQIGYOFISMT-UHFFFAOYSA-N
XLogP2.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3,7,11-Trimethyl-dodeca-2,6,10-trienyl)-(2,6,10-trimethyl-undeca-5,9-dienyl)-amine
CID 10431909
2-(1-Cyclohexen-1-YL)-N-(cyclohexylmethyl)-1-ethanamine hydrochloride
CID 11948824
2,6-Diallyl-4-methyl-1,2,3,6-tetrahydropyridine
CID 2859356
N-methyl-1-(2,4,6-trimethylcyclohex-3-en-1-yl)methanamine
CID 2855350
(2S,6S)-2,6-Diallyl-4-methyl-1,2,3,6-tetrahydropyridine
CID 2063692
Ethylamine, N-allyl-2-(2-cyclopentenyl)-1-methyl-
CID 49661
3-Cyclohexene-1-methylamine, N-cyclopropyl-
CID 204181
(3,7-Dimethyloct-6-en-1-yl)(methyl)amine
CID 22251448
3-[(1R)-4-methylcyclohex-3-en-1-yl]-N-propylbutan-1-amine
CID 24850676
3-[(1R)-4-methylcyclohex-3-en-1-yl]-N-propan-2-ylbutan-1-amine
CID 46886826
Hexahydro-cyclopenta(c)pyridine
CID 69895823
Pyridine, 1,2,5,6-tetrahydro-4-isopropyl-
CID 23423759

Frequently Asked Questions

What is the IUPAC name of 4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine?
The IUPAC name of 4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine (CID 123480536) is 4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine.
What is the SMILES notation for 4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine?
The canonical SMILES for 4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine is C=CC(CC)C1=CCNCC1.
What is the InChIKey of 4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine?
The InChIKey is WMPGQIGYOFISMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-3-9(4-2)10-5-7-11-8-6-10/h3,5,9,11H,1,4,6-8H2,2H3.
What are the key properties of 4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine?
4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine has a molecular weight of 151.25 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pent-1-en-3-yl-1,2,3,6-tetrahydropyridine is sourced from PubChem (CID 123480536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).