1,3-dihydropyridin-3-id-4-one;rutherfordium

C5H4NORf- — CID 164681702

IUPAC1,3-dihydropyridin-3-id-4-one;rutherfordium
SMILESO=c1[c-]c[nH]cc1.[Rf]
InChIInChI=1S/C5H4NO.Rf/c7-5-1-3-6-4-2-5;/h1,3-4H,(H,6,7);/q-1;
InChIKeySOCFGTFPRRKKMH-UHFFFAOYSA-N
MW361.09 g/mol
LogP0.18
Rot. Bonds

About 1,3-dihydropyridin-3-id-4-one;rutherfordium

1,3-dihydropyridin-3-id-4-one;rutherfordium (PubChem CID 164681702) has the molecular formula C5H4NORf- and a molecular weight of 361.09 g/mol. Its IUPAC name is 1,3-dihydropyridin-3-id-4-one;rutherfordium.

Molecular Properties

Compound Name1,3-dihydropyridin-3-id-4-one;rutherfordium
PubChem CID164681702
Molecular FormulaC5H4NORf-
Molecular Weight361.09 g/mol
Exact Mass361.15
IUPAC Name1,3-dihydropyridin-3-id-4-one;rutherfordium
SMILESO=c1[c-]c[nH]cc1.[Rf]
InChIInChI=1S/C5H4NO.Rf/c7-5-1-3-6-4-2-5;/h1,3-4H,(H,6,7);/q-1;
InChIKeySOCFGTFPRRKKMH-UHFFFAOYSA-N
XLogP0.18
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.09
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,3-dihydropyridin-3-id-4-one;rutherfordium?
The IUPAC name of 1,3-dihydropyridin-3-id-4-one;rutherfordium (CID 164681702) is 1,3-dihydropyridin-3-id-4-one;rutherfordium.
What is the SMILES notation for 1,3-dihydropyridin-3-id-4-one;rutherfordium?
The canonical SMILES for 1,3-dihydropyridin-3-id-4-one;rutherfordium is O=c1[c-]c[nH]cc1.[Rf].
What is the InChIKey of 1,3-dihydropyridin-3-id-4-one;rutherfordium?
The InChIKey is SOCFGTFPRRKKMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4NO.Rf/c7-5-1-3-6-4-2-5;/h1,3-4H,(H,6,7);/q-1;.
What are the key properties of 1,3-dihydropyridin-3-id-4-one;rutherfordium?
1,3-dihydropyridin-3-id-4-one;rutherfordium has a molecular weight of 361.09 g/mol, XLogP of 0.18, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dihydropyridin-3-id-4-one;rutherfordium is sourced from PubChem (CID 164681702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).