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

C19H14ClN3O — CID 129052008

IUPAC1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
SMILESO=c1ccc(-c2ccc3cn[nH]c3c2)cn1Cc1cccc(Cl)c1
InChIInChI=1S/C19H14ClN3O/c20-17-3-1-2-13(8-17)11-23-12-16(6-7-19(23)24)14-4-5-15-10-21-22-18(15)9-14/h1-10,12H,11H2,(H,21,22)
InChIKeyCDELWNRTTCPMLW-UHFFFAOYSA-N
MW335.79 g/mol
LogP4.09
Rot. Bonds3

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

1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one (PubChem CID 129052008) has the molecular formula C19H14ClN3O and a molecular weight of 335.79 g/mol. Its IUPAC name is 1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one.

Molecular Properties

Compound Name1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
PubChem CID129052008
Molecular FormulaC19H14ClN3O
Molecular Weight335.79 g/mol
Exact Mass335.08
IUPAC Name1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
SMILESO=c1ccc(-c2ccc3cn[nH]c3c2)cn1Cc1cccc(Cl)c1
InChIInChI=1S/C19H14ClN3O/c20-17-3-1-2-13(8-17)11-23-12-16(6-7-19(23)24)14-4-5-15-10-21-22-18(15)9-14/h1-10,12H,11H2,(H,21,22)
InChIKeyCDELWNRTTCPMLW-UHFFFAOYSA-N
XLogP4.09
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.79
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-Amino-1H-indazol-6-yl)-1-[(3-chlorophenyl)methyl]pyridin-2-one
CID 129052025
1-(4-(1H-indazol-5-ylamino)piperidin-1-yl)-2-amino-2-(3-chlorophenyl)ethanone
CID 16662116
6-(3-chlorophenyl)-4-(1H-indazol-5-yl)pyrimidin-2(1H)-one
CID 24759582
5-(1H-indazol-6-yl)-1-[[2-(trifluoromethyl)phenyl]methyl]pyridin-2-one
CID 129052048
2-[[5-(1H-indazol-6-yl)-2-oxo-1-pyridinyl]methyl]benzamide
CID 129052051
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
5-(3-amino-1H-indazol-6-yl)-1-benzylpyridin-2-one
CID 129052096
3-[[5-(1H-indazol-6-yl)-2-oxo-1-pyridinyl]methyl]benzamide
CID 129052097
1-[(2-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
CID 129052101

Frequently Asked Questions

What is the IUPAC name of 1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one?
The IUPAC name of 1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one (CID 129052008) is 1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one.
What is the SMILES notation for 1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one?
The canonical SMILES for 1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one is O=c1ccc(-c2ccc3cn[nH]c3c2)cn1Cc1cccc(Cl)c1.
What is the InChIKey of 1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one?
The InChIKey is CDELWNRTTCPMLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN3O/c20-17-3-1-2-13(8-17)11-23-12-16(6-7-19(23)24)14-4-5-15-10-21-22-18(15)9-14/h1-10,12H,11H2,(H,21,22).
What are the key properties of 1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one?
1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one has a molecular weight of 335.79 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-chlorophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one is sourced from PubChem (CID 129052008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).