6-prop-1-en-2-yl-2,3-dihydropyridine

C8H11N — CID 143332140

IUPAC6-prop-1-en-2-yl-2,3-dihydropyridine
SMILESC=C(C)C1=NCCC=C1
InChIInChI=1S/C8H11N/c1-7(2)8-5-3-4-6-9-8/h3,5H,1,4,6H2,2H3
InChIKeyRUTLVCTXKRCZFV-UHFFFAOYSA-N
MW121.18 g/mol
LogP1.96
Rot. Bonds1

About 6-prop-1-en-2-yl-2,3-dihydropyridine

6-prop-1-en-2-yl-2,3-dihydropyridine (PubChem CID 143332140) has the molecular formula C8H11N and a molecular weight of 121.18 g/mol. Its IUPAC name is 6-prop-1-en-2-yl-2,3-dihydropyridine.

Molecular Properties

Compound Name6-prop-1-en-2-yl-2,3-dihydropyridine
PubChem CID143332140
Molecular FormulaC8H11N
Molecular Weight121.18 g/mol
Exact Mass121.09
IUPAC Name6-prop-1-en-2-yl-2,3-dihydropyridine
SMILESC=C(C)C1=NCCC=C1
InChIInChI=1S/C8H11N/c1-7(2)8-5-3-4-6-9-8/h3,5H,1,4,6H2,2H3
InChIKeyRUTLVCTXKRCZFV-UHFFFAOYSA-N
XLogP1.96
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.18
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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3h-Quinoline
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3Hlutidine
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2-methyl-2H-indole
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6-Ethyl-2,3-dihydropyridine
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(2S)-6-(2-fluoroethyl)-2-methyl-2,3-dihydropyridine
CID 67991646
6-Ethyl-5-fluoro-3-methyl-2,3-dihydropyridine
CID 91228283
(Z)-2-fluoro-N,4-dimethylhex-4-en-3-imine
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(E)-N-(2-fluoro-2-methylpropyl)-3-methylpent-3-en-2-imine
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Frequently Asked Questions

What is the IUPAC name of 6-prop-1-en-2-yl-2,3-dihydropyridine?
The IUPAC name of 6-prop-1-en-2-yl-2,3-dihydropyridine (CID 143332140) is 6-prop-1-en-2-yl-2,3-dihydropyridine.
What is the SMILES notation for 6-prop-1-en-2-yl-2,3-dihydropyridine?
The canonical SMILES for 6-prop-1-en-2-yl-2,3-dihydropyridine is C=C(C)C1=NCCC=C1.
What is the InChIKey of 6-prop-1-en-2-yl-2,3-dihydropyridine?
The InChIKey is RUTLVCTXKRCZFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N/c1-7(2)8-5-3-4-6-9-8/h3,5H,1,4,6H2,2H3.
What are the key properties of 6-prop-1-en-2-yl-2,3-dihydropyridine?
6-prop-1-en-2-yl-2,3-dihydropyridine has a molecular weight of 121.18 g/mol, XLogP of 1.96, 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-dihydropyridine is sourced from PubChem (CID 143332140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).