6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one

C14H9Cl2N3O — CID 91546639

IUPAC6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one
SMILESO=c1[nH]c(-c2ccc(Cl)cc2Cl)ccc1-c1ncc[nH]1
InChIInChI=1S/C14H9Cl2N3O/c15-8-1-2-9(11(16)7-8)12-4-3-10(14(20)19-12)13-17-5-6-18-13/h1-7H,(H,17,18)(H,19,20)
InChIKeyPIEMDMVSINDTJR-UHFFFAOYSA-N
MW306.15 g/mol
LogP3.74
Rot. Bonds2

About 6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one

6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one (PubChem CID 91546639) has the molecular formula C14H9Cl2N3O and a molecular weight of 306.15 g/mol. Its IUPAC name is 6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one
PubChem CID91546639
Molecular FormulaC14H9Cl2N3O
Molecular Weight306.15 g/mol
Exact Mass305.01
IUPAC Name6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one
SMILESO=c1[nH]c(-c2ccc(Cl)cc2Cl)ccc1-c1ncc[nH]1
InChIInChI=1S/C14H9Cl2N3O/c15-8-1-2-9(11(16)7-8)12-4-3-10(14(20)19-12)13-17-5-6-18-13/h1-7H,(H,17,18)(H,19,20)
InChIKeyPIEMDMVSINDTJR-UHFFFAOYSA-N
XLogP3.74
TPSA61.54 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.15
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one?
The IUPAC name of 6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one (CID 91546639) is 6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one.
What is the SMILES notation for 6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one?
The canonical SMILES for 6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one is O=c1[nH]c(-c2ccc(Cl)cc2Cl)ccc1-c1ncc[nH]1.
What is the InChIKey of 6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one?
The InChIKey is PIEMDMVSINDTJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2N3O/c15-8-1-2-9(11(16)7-8)12-4-3-10(14(20)19-12)13-17-5-6-18-13/h1-7H,(H,17,18)(H,19,20).
What are the key properties of 6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one?
6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one has a molecular weight of 306.15 g/mol, XLogP of 3.74, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dichlorophenyl)-3-(1H-imidazol-2-yl)-1H-pyridin-2-one is sourced from PubChem (CID 91546639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).