4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one

C21H19N5O2 — CID 24759584

IUPAC4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one
SMILESO=c1nc(-c2ccc3[nH]ncc3c2)cc(-c2ccc(N3CCOCC3)cc2)[nH]1
InChIInChI=1S/C21H19N5O2/c27-21-23-19(14-1-4-17(5-2-14)26-7-9-28-10-8-26)12-20(24-21)15-3-6-18-16(11-15)13-22-25-18/h1-6,11-13H,7-10H2,(H,22,25)(H,23,24,27)
InChIKeyDOEHVWLAIRVIKN-UHFFFAOYSA-N
MW373.42 g/mol
LogP2.82
Rot. Bonds3

About 4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one

4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one (PubChem CID 24759584) has the molecular formula C21H19N5O2 and a molecular weight of 373.42 g/mol. Its IUPAC name is 4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one.

Molecular Properties

Compound Name4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one
PubChem CID24759584
Molecular FormulaC21H19N5O2
Molecular Weight373.42 g/mol
Exact Mass373.15
IUPAC Name4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one
SMILESO=c1nc(-c2ccc3[nH]ncc3c2)cc(-c2ccc(N3CCOCC3)cc2)[nH]1
InChIInChI=1S/C21H19N5O2/c27-21-23-19(14-1-4-17(5-2-14)26-7-9-28-10-8-26)12-20(24-21)15-3-6-18-16(11-15)13-22-25-18/h1-6,11-13H,7-10H2,(H,22,25)(H,23,24,27)
InChIKeyDOEHVWLAIRVIKN-UHFFFAOYSA-N
XLogP2.82
TPSA86.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[1-[2-(1H-indazol-5-yl)phenyl]pyrazol-4-yl]morpholine
CID 141218974
2-amino-6-(4-morpholin-4-ylphenyl)-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
CID 136501828
4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one
CID 59028174
4-(1H-indazol-5-yl)-6-piperidin-1-yl-1H-pyridin-2-one
CID 59028194
4-(4-hydroxy-3-methylphenyl)-6-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-1H-pyrimidin-2-one
CID 135900164
N-(2-morpholin-4-yl-6-phenylpyrimidin-4-yl)-1H-indazol-5-amine
CID 52944867
N-[6-(4-methylsulfonylphenyl)-2-morpholin-4-ylpyrimidin-4-yl]-1H-indazol-5-amine
CID 59789685
6-[4-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]phenyl]-4-phenyl-1H-pyrimidin-2-one
CID 167440252
N-[6-(3-chlorophenyl)-2-morpholin-4-ylpyrimidin-4-yl]-1H-indazol-5-amine
CID 52946107
4-[4-(2-methyl-1H-imidazol-5-yl)phenyl]morpholine
CID 58874981
N-[6-(4-methoxy-3-methylphenyl)-2-morpholin-4-ylpyrimidin-4-yl]-1H-indazol-5-amine
CID 59789810
N-[3-[6-(1H-indazol-5-ylamino)-2-morpholin-4-ylpyrimidin-4-yl]phenyl]hydroxylamine
CID 89423887

Frequently Asked Questions

What is the IUPAC name of 4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one?
The IUPAC name of 4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one (CID 24759584) is 4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one.
What is the SMILES notation for 4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one?
The canonical SMILES for 4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one is O=c1nc(-c2ccc3[nH]ncc3c2)cc(-c2ccc(N3CCOCC3)cc2)[nH]1.
What is the InChIKey of 4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one?
The InChIKey is DOEHVWLAIRVIKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2/c27-21-23-19(14-1-4-17(5-2-14)26-7-9-28-10-8-26)12-20(24-21)15-3-6-18-16(11-15)13-22-25-18/h1-6,11-13H,7-10H2,(H,22,25)(H,23,24,27).
What are the key properties of 4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one?
4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one has a molecular weight of 373.42 g/mol, XLogP of 2.82, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-indazol-5-yl)-6-(4-morpholin-4-ylphenyl)-1H-pyrimidin-2-one is sourced from PubChem (CID 24759584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).