2-aminopropanoic acid;2-chlorobenzaldehyde;copper

C10H12ClCuNO3 — CID 175322684

IUPAC2-aminopropanoic acid;2-chlorobenzaldehyde;copper
SMILESCC(N)C(=O)O.O=Cc1ccccc1Cl.[Cu]
InChIInChI=1S/C7H5ClO.C3H7NO2.Cu/c8-7-4-2-1-3-6(7)5-9;1-2(4)3(5)6;/h1-5H;2H,4H2,1H3,(H,5,6);
InChIKeyOJDLCZCTXVDIQB-UHFFFAOYSA-N
MW293.21 g/mol
LogP1.57
Rot. Bonds2

About 2-aminopropanoic acid;2-chlorobenzaldehyde;copper

2-aminopropanoic acid;2-chlorobenzaldehyde;copper (PubChem CID 175322684) has the molecular formula C10H12ClCuNO3 and a molecular weight of 293.21 g/mol. Its IUPAC name is 2-aminopropanoic acid;2-chlorobenzaldehyde;copper.

Molecular Properties

Compound Name2-aminopropanoic acid;2-chlorobenzaldehyde;copper
PubChem CID175322684
Molecular FormulaC10H12ClCuNO3
Molecular Weight293.21 g/mol
Exact Mass291.98
IUPAC Name2-aminopropanoic acid;2-chlorobenzaldehyde;copper
SMILESCC(N)C(=O)O.O=Cc1ccccc1Cl.[Cu]
InChIInChI=1S/C7H5ClO.C3H7NO2.Cu/c8-7-4-2-1-3-6(7)5-9;1-2(4)3(5)6;/h1-5H;2H,4H2,1H3,(H,5,6);
InChIKeyOJDLCZCTXVDIQB-UHFFFAOYSA-N
XLogP1.57
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.21
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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2,3-dichlorobenzaldehyde;methanol
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2-chlorobenzaldehyde;(2R)-2-(2-chlorophenyl)-2-hydroxyacetonitrile
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(E)-3-(2-chlorophenyl)prop-2-enoic acid
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(2S)-2-aminopropanoic acid
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(2S)-2-aminopropanoic acid
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(2R)-2-aminopropanoic acid
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N-(2-chloro-6-formylphenyl)benzamide
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(2S)-2-[(2-formylphenyl)methylideneamino]-3-methylbutanoic acid
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Frequently Asked Questions

What is the IUPAC name of 2-aminopropanoic acid;2-chlorobenzaldehyde;copper?
The IUPAC name of 2-aminopropanoic acid;2-chlorobenzaldehyde;copper (CID 175322684) is 2-aminopropanoic acid;2-chlorobenzaldehyde;copper.
What is the SMILES notation for 2-aminopropanoic acid;2-chlorobenzaldehyde;copper?
The canonical SMILES for 2-aminopropanoic acid;2-chlorobenzaldehyde;copper is CC(N)C(=O)O.O=Cc1ccccc1Cl.[Cu].
What is the InChIKey of 2-aminopropanoic acid;2-chlorobenzaldehyde;copper?
The InChIKey is OJDLCZCTXVDIQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClO.C3H7NO2.Cu/c8-7-4-2-1-3-6(7)5-9;1-2(4)3(5)6;/h1-5H;2H,4H2,1H3,(H,5,6);.
What are the key properties of 2-aminopropanoic acid;2-chlorobenzaldehyde;copper?
2-aminopropanoic acid;2-chlorobenzaldehyde;copper has a molecular weight of 293.21 g/mol, XLogP of 1.57, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminopropanoic acid;2-chlorobenzaldehyde;copper is sourced from PubChem (CID 175322684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).