4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one

C16H16N4O — CID 59028174

IUPAC4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one
SMILESO=c1cc(-c2ccc3[nH]ncc3c2)cc(N2CCCC2)[nH]1
InChIInChI=1S/C16H16N4O/c21-16-9-12(8-15(18-16)20-5-1-2-6-20)11-3-4-14-13(7-11)10-17-19-14/h3-4,7-10H,1-2,5-6H2,(H,17,19)(H,18,21)
InChIKeyBSZYKERTXVERPP-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.52
Rot. Bonds2

About 4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one

4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one (PubChem CID 59028174) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one.

Molecular Properties

Compound Name4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one
PubChem CID59028174
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one
SMILESO=c1cc(-c2ccc3[nH]ncc3c2)cc(N2CCCC2)[nH]1
InChIInChI=1S/C16H16N4O/c21-16-9-12(8-15(18-16)20-5-1-2-6-20)11-3-4-14-13(7-11)10-17-19-14/h3-4,7-10H,1-2,5-6H2,(H,17,19)(H,18,21)
InChIKeyBSZYKERTXVERPP-UHFFFAOYSA-N
XLogP2.52
TPSA64.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-benzylpyrrolidin-3-yl)-1H-indazole
CID 44231144
1-[(1-ethyl-2,3-dihydro-1H-indol-5-yl)methyl]-3-1H-indazol-4-ylurea
CID 16749466
1-({4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-3-methylphenyl}methyl)-3-1H-indazol-4-ylurea
CID 16749566
2-(cyclohexylamino)-4-(1H-indazol-5-yl)-1H-pyrimidin-6-one
CID 136042389
1-cyclopentyl-1-[[3-(1H-pyrazol-5-yl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea
CID 10597258
4-(1H-indazol-5-yl)-6-phenylpyrimidin-2(1H)-one
CID 16661285
6-(3-fluorophenyl)-4-(1H-indazol-5-yl)pyrimidin-2(1H)-one
CID 24759475
6-(4-ethylphenyl)-4-(1H-indazol-5-yl)pyrimidin-2(1H)-one
CID 24759479
4-(1H-indazol-5-yl)-6-(3-(trifluoromethyl)phenyl)pyrimidin-2(1H)-one
CID 24759580
6-(2-fluorophenyl)-4-(1H-indazol-5-yl)pyrimidin-2(1H)-one
CID 24759581
4-(1h-Indazol-5-yl)-6-(4-piperazin-1-ylphenyl)pyrimidin-2(1h)-one
CID 24759685
1-[(3-aminophenyl)methyl]-5-(1H-indazol-6-yl)pyridin-2-one
CID 129052116

Frequently Asked Questions

What is the IUPAC name of 4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one?
The IUPAC name of 4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one (CID 59028174) is 4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one.
What is the SMILES notation for 4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one?
The canonical SMILES for 4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one is O=c1cc(-c2ccc3[nH]ncc3c2)cc(N2CCCC2)[nH]1.
What is the InChIKey of 4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one?
The InChIKey is BSZYKERTXVERPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c21-16-9-12(8-15(18-16)20-5-1-2-6-20)11-3-4-14-13(7-11)10-17-19-14/h3-4,7-10H,1-2,5-6H2,(H,17,19)(H,18,21).
What are the key properties of 4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one?
4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one has a molecular weight of 280.33 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one is sourced from PubChem (CID 59028174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).