4-[(E)-4-methylpent-1-enyl]pyridine

C11H15N — CID 118334247

IUPAC4-[(E)-4-methylpent-1-enyl]pyridine
SMILESCC(C)C/C=C/c1ccncc1
InChIInChI=1S/C11H15N/c1-10(2)4-3-5-11-6-8-12-9-7-11/h3,5-10H,4H2,1-2H3/b5-3+
InChIKeyOALYLTWTHCHGFR-HWKANZROSA-N
MW161.25 g/mol
LogP3.14
Rot. Bonds3

About 4-[(E)-4-methylpent-1-enyl]pyridine

4-[(E)-4-methylpent-1-enyl]pyridine (PubChem CID 118334247) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is 4-[(E)-4-methylpent-1-enyl]pyridine.

Molecular Properties

Compound Name4-[(E)-4-methylpent-1-enyl]pyridine
PubChem CID118334247
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name4-[(E)-4-methylpent-1-enyl]pyridine
SMILESCC(C)C/C=C/c1ccncc1
InChIInChI=1S/C11H15N/c1-10(2)4-3-5-11-6-8-12-9-7-11/h3,5-10H,4H2,1-2H3/b5-3+
InChIKeyOALYLTWTHCHGFR-HWKANZROSA-N
XLogP3.14
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Nicotine
CID 89594
Pyridine
CID 1049
Cetylpyridinium Chloride
CID 31239
Paraquat dichloride
CID 15938
Ethionamide
CID 2761171
3-Methylpyridine
CID 7970
3-(1-Methylpyrrolidin-2-yl)pyridine
CID 942
4-Methylpyridine
CID 7963
Pheniramine
CID 4761
Cetylpyridinium Bromide
CID 8816
4-Vinylpyridine
CID 7502
2-Amino-4-methylpyridine
CID 1533

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-4-methylpent-1-enyl]pyridine?
The IUPAC name of 4-[(E)-4-methylpent-1-enyl]pyridine (CID 118334247) is 4-[(E)-4-methylpent-1-enyl]pyridine.
What is the SMILES notation for 4-[(E)-4-methylpent-1-enyl]pyridine?
The canonical SMILES for 4-[(E)-4-methylpent-1-enyl]pyridine is CC(C)C/C=C/c1ccncc1.
What is the InChIKey of 4-[(E)-4-methylpent-1-enyl]pyridine?
The InChIKey is OALYLTWTHCHGFR-HWKANZROSA-N. The full InChI is InChI=1S/C11H15N/c1-10(2)4-3-5-11-6-8-12-9-7-11/h3,5-10H,4H2,1-2H3/b5-3+.
What are the key properties of 4-[(E)-4-methylpent-1-enyl]pyridine?
4-[(E)-4-methylpent-1-enyl]pyridine has a molecular weight of 161.25 g/mol, XLogP of 3.14, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-4-methylpent-1-enyl]pyridine is sourced from PubChem (CID 118334247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).