1-phenylpyrrolidin-2-one;tungsten

C10H10NOW- — CID 58841050

IUPAC1-phenylpyrrolidin-2-one;tungsten
SMILESO=C1CCCN1c1cc[c-]cc1.[W]
InChIInChI=1S/C10H10NO.W/c12-10-7-4-8-11(10)9-5-2-1-3-6-9;/h2-3,5-6H,4,7-8H2;/q-1;
InChIKeyBZWJKGWJCBTULP-UHFFFAOYSA-N
MW344.04 g/mol
LogP1.61
Rot. Bonds1

About 1-phenylpyrrolidin-2-one;tungsten

1-phenylpyrrolidin-2-one;tungsten (PubChem CID 58841050) has the molecular formula C10H10NOW- and a molecular weight of 344.04 g/mol. Its IUPAC name is 1-phenylpyrrolidin-2-one;tungsten.

Molecular Properties

Compound Name1-phenylpyrrolidin-2-one;tungsten
PubChem CID58841050
Molecular FormulaC10H10NOW-
Molecular Weight344.04 g/mol
Exact Mass344.03
IUPAC Name1-phenylpyrrolidin-2-one;tungsten
SMILESO=C1CCCN1c1cc[c-]cc1.[W]
InChIInChI=1S/C10H10NO.W/c12-10-7-4-8-11(10)9-5-2-1-3-6-9;/h2-3,5-6H,4,7-8H2;/q-1;
InChIKeyBZWJKGWJCBTULP-UHFFFAOYSA-N
XLogP1.61
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.04
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Cyclohexa-1,5-dien-1-ylpyrrolidin-2-one
CID 18406759
1-Buta-1,3-dien-2-ylpyrrolidin-2-one
CID 20184390
1-[(E)-but-2-en-2-yl]pyrrolidin-2-one
CID 21518592
1-But-2-en-2-ylpyrrolidin-2-one
CID 54400713
1-Hepta-1,3,5-trien-4-ylpyrrolidin-2-one
CID 59893694
5-Methylidene-1-prop-2-enylpyrrolidin-2-one
CID 66778560
1-(2,5-Dimethylhexa-2,4-dien-3-yl)pyrrolidin-2-one
CID 89263305
1-[(3E)-hexa-1,3,5-trien-3-yl]pyrrolidin-2-one
CID 126488737
ethane;4-methyl-1-[(3E,5Z)-octa-1,3,5,7-tetraen-3-yl]pyrrolidin-2-one
CID 141911273
ethane;1-[(2E,4Z)-hexa-2,4-dien-2-yl]-4-methylpyrrolidin-2-one
CID 141921290
ethane;1-[(3E)-6-methylhepta-1,3,5-trien-3-yl]pyrrolidin-2-one
CID 142308897
1-Cyclohepta-1,3,4,6-tetraen-1-ylpyrrolidin-2-one;ethane
CID 143906545

Frequently Asked Questions

What is the IUPAC name of 1-phenylpyrrolidin-2-one;tungsten?
The IUPAC name of 1-phenylpyrrolidin-2-one;tungsten (CID 58841050) is 1-phenylpyrrolidin-2-one;tungsten.
What is the SMILES notation for 1-phenylpyrrolidin-2-one;tungsten?
The canonical SMILES for 1-phenylpyrrolidin-2-one;tungsten is O=C1CCCN1c1cc[c-]cc1.[W].
What is the InChIKey of 1-phenylpyrrolidin-2-one;tungsten?
The InChIKey is BZWJKGWJCBTULP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10NO.W/c12-10-7-4-8-11(10)9-5-2-1-3-6-9;/h2-3,5-6H,4,7-8H2;/q-1;.
What are the key properties of 1-phenylpyrrolidin-2-one;tungsten?
1-phenylpyrrolidin-2-one;tungsten has a molecular weight of 344.04 g/mol, XLogP of 1.61, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenylpyrrolidin-2-one;tungsten is sourced from PubChem (CID 58841050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).