6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine

C8H13N — CID 135085650

IUPAC6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine
SMILESC=C(C)C1=NCCCC1
InChIInChI=1S/C8H13N/c1-7(2)8-5-3-4-6-9-8/h1,3-6H2,2H3
InChIKeyRFBMJTYQNIXEKV-UHFFFAOYSA-N
MW123.20 g/mol
LogP2.19
Rot. Bonds1

About 6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine

6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine (PubChem CID 135085650) has the molecular formula C8H13N and a molecular weight of 123.20 g/mol. Its IUPAC name is 6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine.

Molecular Properties

Compound Name6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine
PubChem CID135085650
Molecular FormulaC8H13N
Molecular Weight123.20 g/mol
Exact Mass123.10
IUPAC Name6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine
SMILESC=C(C)C1=NCCCC1
InChIInChI=1S/C8H13N/c1-7(2)8-5-3-4-6-9-8/h1,3-6H2,2H3
InChIKeyRFBMJTYQNIXEKV-UHFFFAOYSA-N
XLogP2.19
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.20
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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5-(3-methylbut-3-enyl)-3,4-dihydro-2H-pyrrole
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5-prop-1-en-2-yl-3,4-dihydro-2H-pyrrole
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CID 69527425
9-methyl-3,4,6,7-tetrahydro-2H-cyclohepta[b]pyridine
CID 90703386
6-methyl-3-methylidene-4,5-dihydro-2H-pyridine
CID 91101587
5-methyl-2-prop-1-en-2-yl-3,4-dihydro-2H-pyrrole
CID 102498818
N-butyl-2-methylcyclohex-2-en-1-imine
CID 123229728
6-methyl-4-methylidene-3,5-dihydro-2H-pyridine
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(5Z)-6-ethyl-5-ethylidene-3,4-dihydro-2H-pyridine
CID 123334877

Frequently Asked Questions

What is the IUPAC name of 6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine?
The IUPAC name of 6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine (CID 135085650) is 6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine.
What is the SMILES notation for 6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine?
The canonical SMILES for 6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine is C=C(C)C1=NCCCC1.
What is the InChIKey of 6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine?
The InChIKey is RFBMJTYQNIXEKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N/c1-7(2)8-5-3-4-6-9-8/h1,3-6H2,2H3.
What are the key properties of 6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine?
6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine has a molecular weight of 123.20 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-prop-1-en-2-yl-2,3,4,5-tetrahydropyridine is sourced from PubChem (CID 135085650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).