5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one

C20H22N4O2 — CID 90400847

IUPAC5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one
SMILESCC(C)Oc1ccc2[nH]nc(-c3ccnc(N4C(=O)CCC4C)c3)c2c1
InChIInChI=1S/C20H22N4O2/c1-12(2)26-15-5-6-17-16(11-15)20(23-22-17)14-8-9-21-18(10-14)24-13(3)4-7-19(24)25/h5-6,8-13H,4,7H2,1-3H3,(H,22,23)
InChIKeyAFMSFBSLYBHJQM-UHFFFAOYSA-N
MW350.42 g/mol
LogP3.93
Rot. Bonds4

About 5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one

5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one (PubChem CID 90400847) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one.

Molecular Properties

Compound Name5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one
PubChem CID90400847
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one
SMILESCC(C)Oc1ccc2[nH]nc(-c3ccnc(N4C(=O)CCC4C)c3)c2c1
InChIInChI=1S/C20H22N4O2/c1-12(2)26-15-5-6-17-16(11-15)20(23-22-17)14-8-9-21-18(10-14)24-13(3)4-7-19(24)25/h5-6,8-13H,4,7H2,1-3H3,(H,22,23)
InChIKeyAFMSFBSLYBHJQM-UHFFFAOYSA-N
XLogP3.93
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one with MolForge

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Launch Full Analysis

Related Compounds

3-[2-[(3S,4S)-3,4-difluoropyrrolidin-1-yl]-4-pyridinyl]-5-propan-2-yloxy-1H-indazole
CID 118657118
3-[2-(3-methylsulfonylazetidin-1-yl)-4-pyridinyl]-5-propan-2-yloxy-1H-indazole
CID 90400858
4-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]piperazin-2-one
CID 90400815
5-propan-2-yloxy-3-[2-[3-(1,2,4-triazol-4-yl)azetidin-1-yl]-4-pyridinyl]-1H-indazole
CID 90400844
5-propan-2-yloxy-3-[2-(3-pyridin-4-ylpyrrolidin-1-yl)-4-pyridinyl]-1H-indazole
CID 90401021
3-[6-[(3S,4S)-3,4-difluoropyrrolidin-1-yl]pyrimidin-4-yl]-5-propan-2-yloxy-1H-indazole
CID 78321838
3-[2-(8-azabicyclo[3.2.1]octan-8-yl)-4-pyridinyl]-5-ethoxy-1H-indazole
CID 123204578
(3R)-5-methyl-1-[6-(5-propan-2-yloxy-1H-indazol-3-yl)pyrimidin-4-yl]pyrrolidin-3-amine
CID 130372041
3-(4-methylpyrimidin-2-yl)-5-propan-2-yloxy-1H-indazole
CID 167172229
4-[4-[5-(2-methoxyethoxy)-1H-indazol-3-yl]-2-pyridinyl]-1-methylpiperazin-2-one
CID 90400966
3-[2-(4-methylsulfinylpiperazin-1-yl)-4-pyridinyl]-5-propan-2-yloxy-1H-pyrazolo[3,4-c]pyridine
CID 139566249
4-methoxy-1-[6-(5-propan-2-yloxy-1H-indazol-3-yl)pyrimidin-4-yl]pyrrolidin-3-ol
CID 123977170

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one?
The IUPAC name of 5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one (CID 90400847) is 5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one.
What is the SMILES notation for 5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one?
The canonical SMILES for 5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one is CC(C)Oc1ccc2[nH]nc(-c3ccnc(N4C(=O)CCC4C)c3)c2c1.
What is the InChIKey of 5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one?
The InChIKey is AFMSFBSLYBHJQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-12(2)26-15-5-6-17-16(11-15)20(23-22-17)14-8-9-21-18(10-14)24-13(3)4-7-19(24)25/h5-6,8-13H,4,7H2,1-3H3,(H,22,23).
What are the key properties of 5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one?
5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one has a molecular weight of 350.42 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-[4-(5-propan-2-yloxy-1H-indazol-3-yl)-2-pyridinyl]pyrrolidin-2-one is sourced from PubChem (CID 90400847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).