CID 159352431

C3H7NOPb — CID 159352431

IUPAC—
SMILESCN(C)C=O.[Pb]
InChIInChI=1S/C3H7NO.Pb/c1-4(2)3-5;/h3H,1-2H3;
InChIKeyLHMNKVQRDBONQF-UHFFFAOYSA-N
MW280.30 g/mol
LogP-0.68
Rot. Bonds1

About CID 159352431

CID 159352431 (PubChem CID 159352431) has the molecular formula C3H7NOPb and a molecular weight of 280.30 g/mol.

Molecular Properties

Compound NameCID 159352431
PubChem CID159352431
Molecular FormulaC3H7NOPb
Molecular Weight280.30 g/mol
Exact Mass281.03
IUPAC Name—
SMILESCN(C)C=O.[Pb]
InChIInChI=1S/C3H7NO.Pb/c1-4(2)3-5;/h3H,1-2H3;
InChIKeyLHMNKVQRDBONQF-UHFFFAOYSA-N
XLogP-0.68
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 5-0.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 159352431?
The IUPAC name of CID 159352431 (CID 159352431) is not available.
What is the SMILES notation for CID 159352431?
The canonical SMILES for CID 159352431 is CN(C)C=O.[Pb].
What is the InChIKey of CID 159352431?
The InChIKey is LHMNKVQRDBONQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO.Pb/c1-4(2)3-5;/h3H,1-2H3;.
What are the key properties of CID 159352431?
CID 159352431 has a molecular weight of 280.30 g/mol, XLogP of -0.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 159352431 is sourced from PubChem (CID 159352431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).