pyridine;styrene;hydrochloride

C13H14ClN — CID 173443954

IUPACpyridine;styrene;hydrochloride
SMILESC=Cc1ccccc1.Cl.c1ccncc1
InChIInChI=1S/C8H8.C5H5N.ClH/c1-2-8-6-4-3-5-7-8;1-2-4-6-5-3-1;/h2-7H,1H2;1-5H;1H
InChIKeySYYGNIHPTOJAKW-UHFFFAOYSA-N
MW219.71 g/mol
LogP3.83
Rot. Bonds1

About pyridine;styrene;hydrochloride

pyridine;styrene;hydrochloride (PubChem CID 173443954) has the molecular formula C13H14ClN and a molecular weight of 219.71 g/mol. Its IUPAC name is pyridine;styrene;hydrochloride.

Molecular Properties

Compound Namepyridine;styrene;hydrochloride
PubChem CID173443954
Molecular FormulaC13H14ClN
Molecular Weight219.71 g/mol
Exact Mass219.08
IUPAC Namepyridine;styrene;hydrochloride
SMILESC=Cc1ccccc1.Cl.c1ccncc1
InChIInChI=1S/C8H8.C5H5N.ClH/c1-2-8-6-4-3-5-7-8;1-2-4-6-5-3-1;/h2-7H,1H2;1-5H;1H
InChIKeySYYGNIHPTOJAKW-UHFFFAOYSA-N
XLogP3.83
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.71
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of pyridine;styrene;hydrochloride?
The IUPAC name of pyridine;styrene;hydrochloride (CID 173443954) is pyridine;styrene;hydrochloride.
What is the SMILES notation for pyridine;styrene;hydrochloride?
The canonical SMILES for pyridine;styrene;hydrochloride is C=Cc1ccccc1.Cl.c1ccncc1.
What is the InChIKey of pyridine;styrene;hydrochloride?
The InChIKey is SYYGNIHPTOJAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8.C5H5N.ClH/c1-2-8-6-4-3-5-7-8;1-2-4-6-5-3-1;/h2-7H,1H2;1-5H;1H.
What are the key properties of pyridine;styrene;hydrochloride?
pyridine;styrene;hydrochloride has a molecular weight of 219.71 g/mol, XLogP of 3.83, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for pyridine;styrene;hydrochloride is sourced from PubChem (CID 173443954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).