1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one

C19H13Cl2N3O — CID 129052150

IUPAC1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
SMILESO=c1ccc(-c2ccc3cn[nH]c3c2)cn1Cc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C19H13Cl2N3O/c20-16-5-1-12(7-17(16)21)10-24-11-15(4-6-19(24)25)13-2-3-14-9-22-23-18(14)8-13/h1-9,11H,10H2,(H,22,23)
InChIKeyZBKQXBZXZYIRIU-UHFFFAOYSA-N
MW370.24 g/mol
LogP4.75
Rot. Bonds3

About 1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one

1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one (PubChem CID 129052150) has the molecular formula C19H13Cl2N3O and a molecular weight of 370.24 g/mol. Its IUPAC name is 1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one.

Molecular Properties

Compound Name1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
PubChem CID129052150
Molecular FormulaC19H13Cl2N3O
Molecular Weight370.24 g/mol
Exact Mass369.04
IUPAC Name1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
SMILESO=c1ccc(-c2ccc3cn[nH]c3c2)cn1Cc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C19H13Cl2N3O/c20-16-5-1-12(7-17(16)21)10-24-11-15(4-6-19(24)25)13-2-3-14-9-22-23-18(14)8-13/h1-9,11H,10H2,(H,22,23)
InChIKeyZBKQXBZXZYIRIU-UHFFFAOYSA-N
XLogP4.75
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.24
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3,4-dichlorophenyl)-N-1H-indazol-5-yl-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxamide
CID 11247002
5-(3-Amino-1H-indazol-6-yl)-1-[(3-chlorophenyl)methyl]pyridin-2-one
CID 129052025
2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide
CID 17167118
1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
CID 129052008
5-(1H-indazol-6-yl)-1-[[2-(trifluoromethyl)phenyl]methyl]pyridin-2-one
CID 129052048
N-[3-[[5-(1H-indazol-6-yl)-2-oxo-1-pyridinyl]methyl]phenyl]acetamide
CID 129052064
5-(1H-indazol-6-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyridin-2-one
CID 129052068
1-[(2-fluorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
CID 129052070
1-benzyl-5-(1H-indazol-6-yl)pyridin-2-one
CID 129052080
1-[(2-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
CID 129052101
1-[(3-aminophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
CID 129052116
1-[(3-fluorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
CID 140931454

Frequently Asked Questions

What is the IUPAC name of 1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one?
The IUPAC name of 1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one (CID 129052150) is 1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one.
What is the SMILES notation for 1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one?
The canonical SMILES for 1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one is O=c1ccc(-c2ccc3cn[nH]c3c2)cn1Cc1ccc(Cl)c(Cl)c1.
What is the InChIKey of 1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one?
The InChIKey is ZBKQXBZXZYIRIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13Cl2N3O/c20-16-5-1-12(7-17(16)21)10-24-11-15(4-6-19(24)25)13-2-3-14-9-22-23-18(14)8-13/h1-9,11H,10H2,(H,22,23).
What are the key properties of 1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one?
1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one has a molecular weight of 370.24 g/mol, XLogP of 4.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,4-dichlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one is sourced from PubChem (CID 129052150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).