1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide

C23H23N5O — CID 69193379

IUPAC1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide
SMILESCc1ccc(Nc2ccc3c(C(=O)N(C)C)nn(Cc4ccccc4)c3n2)cc1
InChIInChI=1S/C23H23N5O/c1-16-9-11-18(12-10-16)24-20-14-13-19-21(23(29)27(2)3)26-28(22(19)25-20)15-17-7-5-4-6-8-17/h4-14H,15H2,1-3H3,(H,24,25)
InChIKeyVZCUNAXQEWNQFL-UHFFFAOYSA-N
MW385.47 g/mol
LogP4.23
Rot. Bonds5

About 1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide

1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide (PubChem CID 69193379) has the molecular formula C23H23N5O and a molecular weight of 385.47 g/mol. Its IUPAC name is 1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide
PubChem CID69193379
Molecular FormulaC23H23N5O
Molecular Weight385.47 g/mol
Exact Mass385.19
IUPAC Name1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide
SMILESCc1ccc(Nc2ccc3c(C(=O)N(C)C)nn(Cc4ccccc4)c3n2)cc1
InChIInChI=1S/C23H23N5O/c1-16-9-11-18(12-10-16)24-20-14-13-19-21(23(29)27(2)3)26-28(22(19)25-20)15-17-7-5-4-6-8-17/h4-14H,15H2,1-3H3,(H,24,25)
InChIKeyVZCUNAXQEWNQFL-UHFFFAOYSA-N
XLogP4.23
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-benzyl-N,N-dimethyl-6-[(4-methylbenzoyl)amino]pyrazolo[5,4-b]pyridine-3-carboxamide
CID 69029430
1-[[4-(dimethylcarbamoyl)phenyl]methyl]-N-(4-methylphenyl)indazole-3-carboxamide
CID 68639909
1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide
CID 135253078
N-[4-[[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino]phenyl]-2-phenylacetamide
CID 50748504
1-benzyl-6-(4-methylphenyl)pyrazolo[5,4-b]pyridine-4-carboxylic acid
CID 113220360
N-benzyl-N-methyl-5-(4-methylanilino)pyrazine-2-carboxamide
CID 109281071
1-benzyl-N,N-dimethyl-2-(2-methylanilino)-4-oxopyrimidine-5-carboxamide
CID 134290420
N-[(1-benzylpyrazol-4-yl)methyl]-N,6-dimethyl-1-[(4-methylphenyl)methyl]pyrazolo[3,4-b]pyridine-4-carboxamide
CID 46650100
6-(4-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 1441265
6-benzyl-N,N,12-trimethyl-2-oxo-1,6,8-triazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
CID 4911231
N-benzyl-N-methyl-2-(4-methylanilino)pyrimidine-4-carboxamide
CID 109305157
1-benzyl-N,N-dimethyl-5-(2-phenylethylamino)-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 45165010

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide?
The IUPAC name of 1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide (CID 69193379) is 1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide.
What is the SMILES notation for 1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide?
The canonical SMILES for 1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide is Cc1ccc(Nc2ccc3c(C(=O)N(C)C)nn(Cc4ccccc4)c3n2)cc1.
What is the InChIKey of 1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide?
The InChIKey is VZCUNAXQEWNQFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O/c1-16-9-11-18(12-10-16)24-20-14-13-19-21(23(29)27(2)3)26-28(22(19)25-20)15-17-7-5-4-6-8-17/h4-14H,15H2,1-3H3,(H,24,25).
What are the key properties of 1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide?
1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide has a molecular weight of 385.47 g/mol, XLogP of 4.23, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N,N-dimethyl-6-(4-methylanilino)pyrazolo[5,4-b]pyridine-3-carboxamide is sourced from PubChem (CID 69193379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).