ethanamine;pyridine;hydrochloride

C7H13ClN2 — CID 174393603

IUPACethanamine;pyridine;hydrochloride
SMILESCCN.Cl.c1ccncc1
InChIInChI=1S/C5H5N.C2H7N.ClH/c1-2-4-6-5-3-1;1-2-3;/h1-5H;2-3H2,1H3;1H
InChIKeyYWGJFWCFMXYYDG-UHFFFAOYSA-N
MW160.65 g/mol
LogP1.47
Rot. Bonds

About ethanamine;pyridine;hydrochloride

ethanamine;pyridine;hydrochloride (PubChem CID 174393603) has the molecular formula C7H13ClN2 and a molecular weight of 160.65 g/mol. Its IUPAC name is ethanamine;pyridine;hydrochloride.

Molecular Properties

Compound Nameethanamine;pyridine;hydrochloride
PubChem CID174393603
Molecular FormulaC7H13ClN2
Molecular Weight160.65 g/mol
Exact Mass160.08
IUPAC Nameethanamine;pyridine;hydrochloride
SMILESCCN.Cl.c1ccncc1
InChIInChI=1S/C5H5N.C2H7N.ClH/c1-2-4-6-5-3-1;1-2-3;/h1-5H;2-3H2,1H3;1H
InChIKeyYWGJFWCFMXYYDG-UHFFFAOYSA-N
XLogP1.47
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.65
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of ethanamine;pyridine;hydrochloride?
The IUPAC name of ethanamine;pyridine;hydrochloride (CID 174393603) is ethanamine;pyridine;hydrochloride.
What is the SMILES notation for ethanamine;pyridine;hydrochloride?
The canonical SMILES for ethanamine;pyridine;hydrochloride is CCN.Cl.c1ccncc1.
What is the InChIKey of ethanamine;pyridine;hydrochloride?
The InChIKey is YWGJFWCFMXYYDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N.C2H7N.ClH/c1-2-4-6-5-3-1;1-2-3;/h1-5H;2-3H2,1H3;1H.
What are the key properties of ethanamine;pyridine;hydrochloride?
ethanamine;pyridine;hydrochloride has a molecular weight of 160.65 g/mol, XLogP of 1.47, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethanamine;pyridine;hydrochloride is sourced from PubChem (CID 174393603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).