2-methylprop-1-ene;pyridine

C9H13N — CID 160671535

IUPAC2-methylprop-1-ene;pyridine
SMILESC=C(C)C.c1ccncc1
InChIInChI=1S/C5H5N.C4H8/c1-2-4-6-5-3-1;1-4(2)3/h1-5H;1H2,2-3H3
InChIKeyRMZJJWYBYHBUBT-UHFFFAOYSA-N
MW135.21 g/mol
LogP2.66
Rot. Bonds

About 2-methylprop-1-ene;pyridine

2-methylprop-1-ene;pyridine (PubChem CID 160671535) has the molecular formula C9H13N and a molecular weight of 135.21 g/mol. Its IUPAC name is 2-methylprop-1-ene;pyridine.

Molecular Properties

Compound Name2-methylprop-1-ene;pyridine
PubChem CID160671535
Molecular FormulaC9H13N
Molecular Weight135.21 g/mol
Exact Mass135.10
IUPAC Name2-methylprop-1-ene;pyridine
SMILESC=C(C)C.c1ccncc1
InChIInChI=1S/C5H5N.C4H8/c1-2-4-6-5-3-1;1-4(2)3/h1-5H;1H2,2-3H3
InChIKeyRMZJJWYBYHBUBT-UHFFFAOYSA-N
XLogP2.66
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.21
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-methylprop-1-ene;pyridine;hydrochloride
CID 173452236
CID 174943555
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acetic acid;ethane;pyridine
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pyridine
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1,5-diazecine
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pyridine
CID 160878650
acetyl bromide;pyridine
CID 87730061
arsane;ethene;pyridine
CID 174457532
arsinous acid;pyridine
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CID 172745480
ethane;methane;pyridine
CID 159650211

Frequently Asked Questions

What is the IUPAC name of 2-methylprop-1-ene;pyridine?
The IUPAC name of 2-methylprop-1-ene;pyridine (CID 160671535) is 2-methylprop-1-ene;pyridine.
What is the SMILES notation for 2-methylprop-1-ene;pyridine?
The canonical SMILES for 2-methylprop-1-ene;pyridine is C=C(C)C.c1ccncc1.
What is the InChIKey of 2-methylprop-1-ene;pyridine?
The InChIKey is RMZJJWYBYHBUBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N.C4H8/c1-2-4-6-5-3-1;1-4(2)3/h1-5H;1H2,2-3H3.
What are the key properties of 2-methylprop-1-ene;pyridine?
2-methylprop-1-ene;pyridine has a molecular weight of 135.21 g/mol, XLogP of 2.66, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylprop-1-ene;pyridine is sourced from PubChem (CID 160671535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).