1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one

C25H26N4O3 — CID 25057645

IUPAC1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one
SMILESO=c1cc(OCc2ccccc2)ccn1-c1ccc2c(cnn2CCN2CCOCC2)c1
InChIInChI=1S/C25H26N4O3/c30-25-17-23(32-19-20-4-2-1-3-5-20)8-9-28(25)22-6-7-24-21(16-22)18-26-29(24)11-10-27-12-14-31-15-13-27/h1-9,16-18H,10-15,19H2
InChIKeyHXYLVVVEGCWIII-UHFFFAOYSA-N
MW430.51 g/mol
LogP3.10
Rot. Bonds7

About 1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one

1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one (PubChem CID 25057645) has the molecular formula C25H26N4O3 and a molecular weight of 430.51 g/mol. Its IUPAC name is 1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one.

Molecular Properties

Compound Name1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one
PubChem CID25057645
Molecular FormulaC25H26N4O3
Molecular Weight430.51 g/mol
Exact Mass430.20
IUPAC Name1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one
SMILESO=c1cc(OCc2ccccc2)ccn1-c1ccc2c(cnn2CCN2CCOCC2)c1
InChIInChI=1S/C25H26N4O3/c30-25-17-23(32-19-20-4-2-1-3-5-20)8-9-28(25)22-6-7-24-21(16-22)18-26-29(24)11-10-27-12-14-31-15-13-27/h1-9,16-18H,10-15,19H2
InChIKeyHXYLVVVEGCWIII-UHFFFAOYSA-N
XLogP3.10
TPSA61.52 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.51
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one?
The IUPAC name of 1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one (CID 25057645) is 1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one.
What is the SMILES notation for 1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one?
The canonical SMILES for 1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one is O=c1cc(OCc2ccccc2)ccn1-c1ccc2c(cnn2CCN2CCOCC2)c1.
What is the InChIKey of 1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one?
The InChIKey is HXYLVVVEGCWIII-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O3/c30-25-17-23(32-19-20-4-2-1-3-5-20)8-9-28(25)22-6-7-24-21(16-22)18-26-29(24)11-10-27-12-14-31-15-13-27/h1-9,16-18H,10-15,19H2.
What are the key properties of 1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one?
1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one has a molecular weight of 430.51 g/mol, XLogP of 3.10, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-morpholin-4-ylethyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one is sourced from PubChem (CID 25057645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).