2-aminopropanoate;hydron;hydrochloride

C3H8ClNO2 — CID 173141944

IUPAC2-aminopropanoate;hydron;hydrochloride
SMILESCC(N)C(=O)[O-].Cl.[H+]
InChIInChI=1S/C3H7NO2.ClH/c1-2(4)3(5)6;/h2H,4H2,1H3,(H,5,6);1H
InChIKeyILYVXUGGBVATGA-UHFFFAOYSA-N
MW125.55 g/mol
LogP-1.38
Rot. Bonds1

About 2-aminopropanoate;hydron;hydrochloride

2-aminopropanoate;hydron;hydrochloride (PubChem CID 173141944) has the molecular formula C3H8ClNO2 and a molecular weight of 125.55 g/mol. Its IUPAC name is 2-aminopropanoate;hydron;hydrochloride.

Molecular Properties

Compound Name2-aminopropanoate;hydron;hydrochloride
PubChem CID173141944
Molecular FormulaC3H8ClNO2
Molecular Weight125.55 g/mol
Exact Mass125.02
IUPAC Name2-aminopropanoate;hydron;hydrochloride
SMILESCC(N)C(=O)[O-].Cl.[H+]
InChIInChI=1S/C3H7NO2.ClH/c1-2(4)3(5)6;/h2H,4H2,1H3,(H,5,6);1H
InChIKeyILYVXUGGBVATGA-UHFFFAOYSA-N
XLogP-1.38
TPSA66.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.55
LogP ≤ 5-1.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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bis((2S)-2-aminopropanoate);palladium(2+)
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potassium 2-aminopropanoate
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calcium;bis((2S)-2-aminopropanoate);pentahydrate
CID 176654568
2-aminopropanoate;carbon dioxide
CID 160850245
2-aminopropanoate;carbon monoxide;ruthenium(2+);chloride
CID 10267295
disodium;2-aminopropanoate;methane;molecular hydrogen;2-oxopropanoate
CID 158115198
2-aminopropanamide;dihydrochloride
CID 19963402
2-amino-3-methylbutanoate
CID 5460778
(2S)-2-aminopropanethioic S-acid;hydrochloride
CID 88799460
sodium;2-aminopropanoic acid;acetate
CID 159185216
bismuth tris(2-amino-3-methylbutanoate)
CID 173224363

Frequently Asked Questions

What is the IUPAC name of 2-aminopropanoate;hydron;hydrochloride?
The IUPAC name of 2-aminopropanoate;hydron;hydrochloride (CID 173141944) is 2-aminopropanoate;hydron;hydrochloride.
What is the SMILES notation for 2-aminopropanoate;hydron;hydrochloride?
The canonical SMILES for 2-aminopropanoate;hydron;hydrochloride is CC(N)C(=O)[O-].Cl.[H+].
What is the InChIKey of 2-aminopropanoate;hydron;hydrochloride?
The InChIKey is ILYVXUGGBVATGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO2.ClH/c1-2(4)3(5)6;/h2H,4H2,1H3,(H,5,6);1H.
What are the key properties of 2-aminopropanoate;hydron;hydrochloride?
2-aminopropanoate;hydron;hydrochloride has a molecular weight of 125.55 g/mol, XLogP of -1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminopropanoate;hydron;hydrochloride is sourced from PubChem (CID 173141944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).