8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one

C20H22N8O2 — CID 158546590

IUPAC8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one
SMILESNc1nn(-c2nccc3c2N=CCC3=O)cc1-c1cnn(CCN2CCOCC2)c1
InChIInChI=1S/C20H22N8O2/c21-19-16(14-11-24-27(12-14)6-5-26-7-9-30-10-8-26)13-28(25-19)20-18-15(1-3-23-20)17(29)2-4-22-18/h1,3-4,11-13H,2,5-10H2,(H2,21,25)
InChIKeyHPENTJQMPQOSGC-UHFFFAOYSA-N
MW406.45 g/mol
LogP1.33
Rot. Bonds5

About 8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one

8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one (PubChem CID 158546590) has the molecular formula C20H22N8O2 and a molecular weight of 406.45 g/mol. Its IUPAC name is 8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one.

Molecular Properties

Compound Name8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one
PubChem CID158546590
Molecular FormulaC20H22N8O2
Molecular Weight406.45 g/mol
Exact Mass406.19
IUPAC Name8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one
SMILESNc1nn(-c2nccc3c2N=CCC3=O)cc1-c1cnn(CCN2CCOCC2)c1
InChIInChI=1S/C20H22N8O2/c21-19-16(14-11-24-27(12-14)6-5-26-7-9-30-10-8-26)13-28(25-19)20-18-15(1-3-23-20)17(29)2-4-22-18/h1,3-4,11-13H,2,5-10H2,(H2,21,25)
InChIKeyHPENTJQMPQOSGC-UHFFFAOYSA-N
XLogP1.33
TPSA116.45 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.45
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

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Related Compounds

8-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-3H-pyrido[3,4-d]pyrimidin-4-one
CID 137053176
2-amino-4-(4-fluorophenyl)-9-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]indeno[1,2-d]pyrimidin-5-one
CID 52920358
N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine
CID 141200703
[7-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1,5-naphthyridin-2-yl]urea
CID 90288240
2-methyl-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-6-(2-phenoxyphenyl)pyridazin-3-one
CID 90025606
4-[3-(4-pyridin-3-ylpyrazol-1-yl)propyl]morpholine
CID 141300555
4-[6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-yl]oxyaniline
CID 58917079
4-[2-[4-(4-methyl-3-morpholin-4-ylsulfonylphenyl)pyrazol-1-yl]ethyl]morpholine
CID 171431398
5-[5-[1-[4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]imidazol-1-yl]cyclobutyl]-2-pyridinyl]pyrimidin-2-amine
CID 174689977
4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine
CID 167366502
4-[2-[4-[5-(cyclopenten-1-yl)-1-sulfanylpyrrolo[2,3-b]pyridin-3-yl]pyrazol-1-yl]ethyl]morpholine
CID 69052356
5-chloro-1-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]indole-2-carboxylic acid
CID 142427738

Frequently Asked Questions

What is the IUPAC name of 8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one?
The IUPAC name of 8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one (CID 158546590) is 8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one.
What is the SMILES notation for 8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one?
The canonical SMILES for 8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one is Nc1nn(-c2nccc3c2N=CCC3=O)cc1-c1cnn(CCN2CCOCC2)c1.
What is the InChIKey of 8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one?
The InChIKey is HPENTJQMPQOSGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N8O2/c21-19-16(14-11-24-27(12-14)6-5-26-7-9-30-10-8-26)13-28(25-19)20-18-15(1-3-23-20)17(29)2-4-22-18/h1,3-4,11-13H,2,5-10H2,(H2,21,25).
What are the key properties of 8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one?
8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one has a molecular weight of 406.45 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[3-amino-4-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrazol-1-yl]-3H-1,7-naphthyridin-4-one is sourced from PubChem (CID 158546590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).