4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine

C12H15N — CID 142220960

IUPAC4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine
SMILESC=Cc1ccncc1/C=C\C(C)C
InChIInChI=1S/C12H15N/c1-4-11-7-8-13-9-12(11)6-5-10(2)3/h4-10H,1H2,2-3H3/b6-5-
InChIKeyDDGYTMJHGHWFRJ-WAYWQWQTSA-N
MW173.26 g/mol
LogP3.39
Rot. Bonds3

About 4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine

4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine (PubChem CID 142220960) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine.

Molecular Properties

Compound Name4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine
PubChem CID142220960
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine
SMILESC=Cc1ccncc1/C=C\C(C)C
InChIInChI=1S/C12H15N/c1-4-11-7-8-13-9-12(11)6-5-10(2)3/h4-10H,1H2,2-3H3/b6-5-
InChIKeyDDGYTMJHGHWFRJ-WAYWQWQTSA-N
XLogP3.39
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 66674858
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3-ethenyl-4-methoxypyridine
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3-ethenyl-4-[(E)-2-methoxyethenyl]pyridine
CID 143895761
(1S)-1-(3-ethenyl-4-pyridinyl)-N-methylethanamine
CID 74890348
ethane;1-ethenyl-4-ethyl-2-[(Z)-3-methylbut-1-enyl]benzene
CID 142526011
4-[2,5-bis(ethenyl)-4-(3-ethenyl-4-pyridinyl)phenyl]-3-ethenylpyridine
CID 102110528
1-ethenyl-2-[2-(2-ethenylphenyl)ethenyl]benzene
CID 162779028
(1E)-1-(4-ethenyl-3-pyridinyl)buta-1,3-dien-1-amine
CID 134350526
4-[(1Z)-buta-1,3-dienyl]-3-(3-methylbutyl)pyridine
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1,2-dimethyl-3-[(Z)-3-methylbut-1-enyl]benzene
CID 143027707

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine?
The IUPAC name of 4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine (CID 142220960) is 4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine.
What is the SMILES notation for 4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine?
The canonical SMILES for 4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine is C=Cc1ccncc1/C=C\C(C)C.
What is the InChIKey of 4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine?
The InChIKey is DDGYTMJHGHWFRJ-WAYWQWQTSA-N. The full InChI is InChI=1S/C12H15N/c1-4-11-7-8-13-9-12(11)6-5-10(2)3/h4-10H,1H2,2-3H3/b6-5-.
What are the key properties of 4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine?
4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine has a molecular weight of 173.26 g/mol, XLogP of 3.39, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-3-[(Z)-3-methylbut-1-enyl]pyridine is sourced from PubChem (CID 142220960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).