6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one

C18H19ClN4O3 — CID 151786711

IUPAC6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one
SMILESCn1nc(CN2CCOCC2)c2c(=O)c(O)c(-c3ccccc3Cl)[nH]c21
InChIInChI=1S/C18H19ClN4O3/c1-22-18-14(13(21-22)10-23-6-8-26-9-7-23)16(24)17(25)15(20-18)11-4-2-3-5-12(11)19/h2-5,25H,6-10H2,1H3,(H,20,24)
InChIKeyRVTKEXAGOSSBCJ-UHFFFAOYSA-N
MW374.83 g/mol
LogP2.12
Rot. Bonds3

About 6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one

6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one (PubChem CID 151786711) has the molecular formula C18H19ClN4O3 and a molecular weight of 374.83 g/mol. Its IUPAC name is 6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one.

Molecular Properties

Compound Name6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one
PubChem CID151786711
Molecular FormulaC18H19ClN4O3
Molecular Weight374.83 g/mol
Exact Mass374.11
IUPAC Name6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one
SMILESCn1nc(CN2CCOCC2)c2c(=O)c(O)c(-c3ccccc3Cl)[nH]c21
InChIInChI=1S/C18H19ClN4O3/c1-22-18-14(13(21-22)10-23-6-8-26-9-7-23)16(24)17(25)15(20-18)11-4-2-3-5-12(11)19/h2-5,25H,6-10H2,1H3,(H,20,24)
InChIKeyRVTKEXAGOSSBCJ-UHFFFAOYSA-N
XLogP2.12
TPSA83.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.83
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(2-chlorophenyl)-5-hydroxy-3-methyl-1-(2-pyrrolidin-1-ylethyl)-7H-pyrazolo[5,4-b]pyridin-4-one
CID 137303526
6-(2-chlorophenyl)-5-hydroxy-3-methyl-1-propan-2-yl-7H-pyrazolo[5,4-b]pyridin-4-one
CID 150296831
6-[2-fluoro-3-(trifluoromethyl)phenyl]-5-hydroxy-3-methyl-1-(2-morpholin-4-ylethyl)-7H-pyrazolo[5,4-b]pyridin-4-one;dihydrochloride
CID 153408764
6-(2,6-difluorophenyl)-5-hydroxy-3-methyl-1-(2-morpholin-4-ylethyl)-7H-pyrazolo[5,4-b]pyridin-4-one
CID 137303457
6-(2-chlorophenyl)-3-[(2-fluorophenyl)methyl]-5-hydroxy-2-methyl-7H-pyrazolo[3,4-b]pyridin-4-one
CID 137303515
6-(2-chlorophenyl)-1-(4-fluoro-2-methylphenyl)-5-hydroxy-3-methyl-7H-pyrazolo[5,4-b]pyridin-4-one
CID 150505736
4-[[2-(2-chlorophenyl)-1,3-thiazol-4-yl]methyl]morpholine
CID 6465501
1-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]-3-methyl-4H-pyrazolo[5,4-c]isoquinolin-5-one
CID 135967452
5-(2-chlorophenyl)-N-(2-morpholin-4-ylethyl)-1,2-oxazole-3-carboxamide
CID 1093869
4-[(5-chloro-1-methyl-3-phenylpyrazol-4-yl)methyl]morpholine
CID 1480828
3-(2-chlorophenyl)-4-(2-morpholin-4-ylethyl)-1H-1,2,4-triazole-5-thione
CID 5044512
4-[(4-chloro-1-methylindazol-3-yl)methyl]piperazine-1-sulfonamide
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Frequently Asked Questions

What is the IUPAC name of 6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one?
The IUPAC name of 6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one (CID 151786711) is 6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one.
What is the SMILES notation for 6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one?
The canonical SMILES for 6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one is Cn1nc(CN2CCOCC2)c2c(=O)c(O)c(-c3ccccc3Cl)[nH]c21.
What is the InChIKey of 6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one?
The InChIKey is RVTKEXAGOSSBCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN4O3/c1-22-18-14(13(21-22)10-23-6-8-26-9-7-23)16(24)17(25)15(20-18)11-4-2-3-5-12(11)19/h2-5,25H,6-10H2,1H3,(H,20,24).
What are the key properties of 6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one?
6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one has a molecular weight of 374.83 g/mol, XLogP of 2.12, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chlorophenyl)-5-hydroxy-1-methyl-3-(morpholin-4-ylmethyl)-7H-pyrazolo[5,4-b]pyridin-4-one is sourced from PubChem (CID 151786711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).