prop-2-en-1-amine;zinc;hydrochloride

C3H8ClNZn — CID 174943881

IUPACprop-2-en-1-amine;zinc;hydrochloride
SMILESC=CCN.Cl.[Zn]
InChIInChI=1S/C3H7N.ClH.Zn/c1-2-3-4;;/h2H,1,3-4H2;1H;
InChIKeyBENYJQLGLZRGNB-UHFFFAOYSA-N
MW158.95 g/mol
LogP0.55
Rot. Bonds1

About prop-2-en-1-amine;zinc;hydrochloride

prop-2-en-1-amine;zinc;hydrochloride (PubChem CID 174943881) has the molecular formula C3H8ClNZn and a molecular weight of 158.95 g/mol. Its IUPAC name is prop-2-en-1-amine;zinc;hydrochloride.

Molecular Properties

Compound Nameprop-2-en-1-amine;zinc;hydrochloride
PubChem CID174943881
Molecular FormulaC3H8ClNZn
Molecular Weight158.95 g/mol
Exact Mass156.96
IUPAC Nameprop-2-en-1-amine;zinc;hydrochloride
SMILESC=CCN.Cl.[Zn]
InChIInChI=1S/C3H7N.ClH.Zn/c1-2-3-4;;/h2H,1,3-4H2;1H;
InChIKeyBENYJQLGLZRGNB-UHFFFAOYSA-N
XLogP0.55
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.95
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

azane;prop-2-en-1-amine;hydrochloride
CID 174769077
fluoromethane;prop-2-en-1-amine
CID 173426164
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CID 67816454
2-methylpropane;prop-2-en-1-amine
CID 161130166
ethane-1,2-diol;prop-2-en-1-amine
CID 87098276
ethenone;prop-2-en-1-amine
CID 173182769
N,N-dimethylprop-2-en-1-amine;prop-2-en-1-amine;hydrochloride
CID 87364859
prop-2-en-1-amine;bis(trihydroxy(sulfanylidene)-λ5-phosphane)
CID 87783946
fluorophosphonic acid;prop-2-en-1-amine
CID 173413969
N-methylprop-2-enamide;prop-2-en-1-amine;hydrochloride
CID 174712757
ethanesulfonic acid;prop-2-en-1-amine
CID 87401120
dimethyl-bis(prop-2-enyl)azanium;prop-2-en-1-amine;chloride
CID 174192098

Frequently Asked Questions

What is the IUPAC name of prop-2-en-1-amine;zinc;hydrochloride?
The IUPAC name of prop-2-en-1-amine;zinc;hydrochloride (CID 174943881) is prop-2-en-1-amine;zinc;hydrochloride.
What is the SMILES notation for prop-2-en-1-amine;zinc;hydrochloride?
The canonical SMILES for prop-2-en-1-amine;zinc;hydrochloride is C=CCN.Cl.[Zn].
What is the InChIKey of prop-2-en-1-amine;zinc;hydrochloride?
The InChIKey is BENYJQLGLZRGNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N.ClH.Zn/c1-2-3-4;;/h2H,1,3-4H2;1H;.
What are the key properties of prop-2-en-1-amine;zinc;hydrochloride?
prop-2-en-1-amine;zinc;hydrochloride has a molecular weight of 158.95 g/mol, XLogP of 0.55, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-en-1-amine;zinc;hydrochloride is sourced from PubChem (CID 174943881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).