4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide

C25H25N5O4 — CID 45256047

IUPAC4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide
SMILES[2H]c1c([2H])c(N2C(=O)C([2H])([2H])CCC2([2H])[2H])c([2H])c([2H])c1N1CC([2H])([2H])c2c(C(N)=O)nn(-c3ccc(OC([2H])([2H])[2H])cc3)c2C1=O
InChIInChI=1S/C25H25N5O4/c1-34-19-11-9-18(10-12-19)30-23-20(22(27-30)24(26)32)13-15-29(25(23)33)17-7-5-16(6-8-17)28-14-3-2-4-21(28)31/h5-12H,2-4,13-15H2,1H3,(H2,26,32)/i1D3,4D2,5D,6D,7D,8D,13D2,14D2
InChIKeyQNZCBYKSOIHPEH-HZXSWLPDSA-N
MW472.59 g/mol
LogP2.70
Rot. Bonds6

About 4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide

4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide (PubChem CID 45256047) has the molecular formula C25H25N5O4 and a molecular weight of 472.59 g/mol. Its IUPAC name is 4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide.

Molecular Properties

Compound Name4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide
PubChem CID45256047
Molecular FormulaC25H25N5O4
Molecular Weight472.59 g/mol
Exact Mass472.27
IUPAC Name4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide
SMILES[2H]c1c([2H])c(N2C(=O)C([2H])([2H])CCC2([2H])[2H])c([2H])c([2H])c1N1CC([2H])([2H])c2c(C(N)=O)nn(-c3ccc(OC([2H])([2H])[2H])cc3)c2C1=O
InChIInChI=1S/C25H25N5O4/c1-34-19-11-9-18(10-12-19)30-23-20(22(27-30)24(26)32)13-15-29(25(23)33)17-7-5-16(6-8-17)28-14-3-2-4-21(28)31/h5-12H,2-4,13-15H2,1H3,(H2,26,32)/i1D3,4D2,5D,6D,7D,8D,13D2,14D2
InChIKeyQNZCBYKSOIHPEH-HZXSWLPDSA-N
XLogP2.70
TPSA110.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500472.59
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide with MolForge

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Related Compounds

4,4,5,5-tetradeuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]pyrazolo[5,4-c]pyridine-3-carboxamide
CID 45254828
4,4-dideuterio-6-[4-(3,3-dideuterio-2-oxopiperidin-1-yl)phenyl]-1-(4-methoxyphenyl)-7-oxo-5H-pyrazolo[5,4-c]pyridine-3-carboxamide
CID 89059681
5,5-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(3,3,4,4,5,5-hexadeuterio-2-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-4H-pyrazolo[5,4-c]pyridine-3-carboxamide
CID 45255048
4,4-dideuterio-6-[4-(3,3-dideuterio-2-oxopiperidin-1-yl)phenyl]-7-oxo-1-(2,3,5,6-tetradeuterio-4-methoxyphenyl)-5H-pyrazolo[5,4-c]pyridine-3-carboxamide
CID 89059625
4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,3,3,4,4-hexadeuterio-6-oxopiperidin-1-yl)phenyl]-1-(2,3,5,6-tetradeuterio-4-methoxyphenyl)-5H-pyrazolo[5,4-c]pyridine-3-carboxamide
CID 89059652
4,4,5,5-tetradeuterio-6-[4-(2,2,3,3,4,4-hexadeuterio-6-oxopiperidin-1-yl)phenyl]-1-(4-methoxyphenyl)-7-oxopyrazolo[5,4-c]pyridine-3-carboxamide
CID 89059669
6-[4-(3,3,4,4,5,5-hexadeuterio-2-oxopiperidin-1-yl)phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 89059700
6-[4-[4-[3-carbamoyl-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridin-6-yl]-N-hydroxyanilino]phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 126495801
1-(4-methoxyphenyl)-7-oxo-6-[4-(1-pyrrolidin-1-ylcyclopropyl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 59020077
N,N-dideuterio-1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 25208012
3-acetyl-1-(4-methoxyphenyl)-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridin-7-one;1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 158695238
1-(4-methoxyphenyl)-6-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 118086878

Frequently Asked Questions

What is the IUPAC name of 4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide?
The IUPAC name of 4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide (CID 45256047) is 4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide.
What is the SMILES notation for 4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide?
The canonical SMILES for 4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide is [2H]c1c([2H])c(N2C(=O)C([2H])([2H])CCC2([2H])[2H])c([2H])c([2H])c1N1CC([2H])([2H])c2c(C(N)=O)nn(-c3ccc(OC([2H])([2H])[2H])cc3)c2C1=O.
What is the InChIKey of 4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide?
The InChIKey is QNZCBYKSOIHPEH-HZXSWLPDSA-N. The full InChI is InChI=1S/C25H25N5O4/c1-34-19-11-9-18(10-12-19)30-23-20(22(27-30)24(26)32)13-15-29(25(23)33)17-7-5-16(6-8-17)28-14-3-2-4-21(28)31/h5-12H,2-4,13-15H2,1H3,(H2,26,32)/i1D3,4D2,5D,6D,7D,8D,13D2,14D2.
What are the key properties of 4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide?
4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide has a molecular weight of 472.59 g/mol, XLogP of 2.70, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dideuterio-7-oxo-6-[2,3,5,6-tetradeuterio-4-(2,2,5,5-tetradeuterio-6-oxopiperidin-1-yl)phenyl]-1-[4-(trideuteriomethoxy)phenyl]-5H-pyrazolo[5,4-c]pyridine-3-carboxamide is sourced from PubChem (CID 45256047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).