arsane;pyrrolidin-2-one

C4H10AsNO — CID 174413202

IUPACarsane;pyrrolidin-2-one
SMILESO=C1CCCN1.[AsH3]
InChIInChI=1S/C4H7NO.AsH3/c6-4-2-1-3-5-4;/h1-3H2,(H,5,6);1H3
InChIKeyHYDGOOJAMJYLEZ-UHFFFAOYSA-N
MW163.05 g/mol
LogP-1.29
Rot. Bonds

About arsane;pyrrolidin-2-one

arsane;pyrrolidin-2-one (PubChem CID 174413202) has the molecular formula C4H10AsNO and a molecular weight of 163.05 g/mol. Its IUPAC name is arsane;pyrrolidin-2-one.

Molecular Properties

Compound Namearsane;pyrrolidin-2-one
PubChem CID174413202
Molecular FormulaC4H10AsNO
Molecular Weight163.05 g/mol
Exact Mass163.00
IUPAC Namearsane;pyrrolidin-2-one
SMILESO=C1CCCN1.[AsH3]
InChIInChI=1S/C4H7NO.AsH3/c6-4-2-1-3-5-4;/h1-3H2,(H,5,6);1H3
InChIKeyHYDGOOJAMJYLEZ-UHFFFAOYSA-N
XLogP-1.29
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.05
LogP ≤ 5-1.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of arsane;pyrrolidin-2-one?
The IUPAC name of arsane;pyrrolidin-2-one (CID 174413202) is arsane;pyrrolidin-2-one.
What is the SMILES notation for arsane;pyrrolidin-2-one?
The canonical SMILES for arsane;pyrrolidin-2-one is O=C1CCCN1.[AsH3].
What is the InChIKey of arsane;pyrrolidin-2-one?
The InChIKey is HYDGOOJAMJYLEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO.AsH3/c6-4-2-1-3-5-4;/h1-3H2,(H,5,6);1H3.
What are the key properties of arsane;pyrrolidin-2-one?
arsane;pyrrolidin-2-one has a molecular weight of 163.05 g/mol, XLogP of -1.29, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for arsane;pyrrolidin-2-one is sourced from PubChem (CID 174413202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).