3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one

C23H27N5O2 — CID 170507575

IUPAC3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
SMILESCCCn1nc(C)c2c1NC(=O)CC2c1cc2ccccc2nc1N1CCOCC1
InChIInChI=1S/C23H27N5O2/c1-3-8-28-23-21(15(2)26-28)17(14-20(29)25-23)18-13-16-6-4-5-7-19(16)24-22(18)27-9-11-30-12-10-27/h4-7,13,17H,3,8-12,14H2,1-2H3,(H,25,29)
InChIKeyCGZGFUUABIOQMM-UHFFFAOYSA-N
MW405.50 g/mol
LogP3.46
Rot. Bonds4

About 3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one

3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one (PubChem CID 170507575) has the molecular formula C23H27N5O2 and a molecular weight of 405.50 g/mol. Its IUPAC name is 3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one.

Molecular Properties

Compound Name3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
PubChem CID170507575
Molecular FormulaC23H27N5O2
Molecular Weight405.50 g/mol
Exact Mass405.22
IUPAC Name3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
SMILESCCCn1nc(C)c2c1NC(=O)CC2c1cc2ccccc2nc1N1CCOCC1
InChIInChI=1S/C23H27N5O2/c1-3-8-28-23-21(15(2)26-28)17(14-20(29)25-23)18-13-16-6-4-5-7-19(16)24-22(18)27-9-11-30-12-10-27/h4-7,13,17H,3,8-12,14H2,1-2H3,(H,25,29)
InChIKeyCGZGFUUABIOQMM-UHFFFAOYSA-N
XLogP3.46
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1,3-dimethyl-4-(7-methyl-2-morpholin-4-ylquinolin-3-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 169422291
1-butyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 169411356
(2S)-1-methyl-2-(2-morpholin-4-ylquinolin-3-yl)-2,3-dihydroquinazolin-4-one
CID 25354642
(4R)-1,3-dimethyl-4-naphthalen-1-yl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 136733990
N-methyl-4-[(4R)-3-methyl-6-oxo-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl]benzenesulfonamide
CID 136820635
(4R)-1-methyl-4-(2-morpholin-4-yl-3-pyridinyl)-3-phenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 136697768
(4R)-3-methyl-4-naphthalen-1-yl-1-pyrimidin-2-yl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 135901629
3-methyl-1-(3-methylbutyl)-4-[4-(4-methylpiperazin-1-yl)phenyl]-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 169417189
2-[2-methoxy-4-[(4S)-3-methyl-6-oxo-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-4-yl]phenoxy]acetamide
CID 136713751
(4R)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-4-(2-methylphenyl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 136828556
ethyl 2-[(4S)-4-(2-methoxyphenyl)-3-methyl-6-oxo-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-1-yl]acetate
CID 136800404
4-(2-bromophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 135584742

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
The IUPAC name of 3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one (CID 170507575) is 3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one.
What is the SMILES notation for 3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
The canonical SMILES for 3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one is CCCn1nc(C)c2c1NC(=O)CC2c1cc2ccccc2nc1N1CCOCC1.
What is the InChIKey of 3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
The InChIKey is CGZGFUUABIOQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N5O2/c1-3-8-28-23-21(15(2)26-28)17(14-20(29)25-23)18-13-16-6-4-5-7-19(16)24-22(18)27-9-11-30-12-10-27/h4-7,13,17H,3,8-12,14H2,1-2H3,(H,25,29).
What are the key properties of 3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one has a molecular weight of 405.50 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(2-morpholin-4-ylquinolin-3-yl)-1-propyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one is sourced from PubChem (CID 170507575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).