6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide

C15H16N6OS — CID 31266028

IUPAC6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1nnc(NC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)s1
InChIInChI=1S/C15H16N6OS/c1-7-12-10(14(22)17-15-19-18-8(2)23-15)6-11(9-4-5-9)16-13(12)21(3)20-7/h6,9H,4-5H2,1-3H3,(H,17,19,22)
InChIKeyPTUYNRNRDDERIY-UHFFFAOYSA-N
MW328.40 g/mol
LogP2.57
Rot. Bonds3

About 6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 31266028) has the molecular formula C15H16N6OS and a molecular weight of 328.40 g/mol. Its IUPAC name is 6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID31266028
Molecular FormulaC15H16N6OS
Molecular Weight328.40 g/mol
Exact Mass328.11
IUPAC Name6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1nnc(NC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)s1
InChIInChI=1S/C15H16N6OS/c1-7-12-10(14(22)17-15-19-18-8(2)23-15)6-11(9-4-5-9)16-13(12)21(3)20-7/h6,9H,4-5H2,1-3H3,(H,17,19,22)
InChIKeyPTUYNRNRDDERIY-UHFFFAOYSA-N
XLogP2.57
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.40
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1,3,6-trimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[3,4-b]pyridine-4-carboxamide
CID 16609438
6-cyclopropyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55513700
6-cyclopropyl-1,3-dimethyl-N-methylsulfonylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 146154521
methyl 6-cyclopropyl-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxylate
CID 19616466
6-cyclopropyl-N-(dicyclopropylmethyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 36574852
6-cyclopropyl-N-(1-ethyl-5-methylpyrazol-4-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 44823436
6-cyclopropyl-1,3-dimethyl-N-(3-methyl-2-pyridinyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 31769500
6-cyclopropyl-N-ethoxy-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 52555845
6-cyclopropyl-N-(2-hydroxypropyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 110886666
6-cyclopropyl-N-(3,5-dichloro-2-pyridinyl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 35337408
6-cyclopropyl-N-(2,3-dihydro-1H-inden-5-yl)-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 35337457
6-cyclopropyl-1,3-dimethyl-N-prop-2-enylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16609834

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide (CID 31266028) is 6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide is Cc1nnc(NC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)s1.
What is the InChIKey of 6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is PTUYNRNRDDERIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6OS/c1-7-12-10(14(22)17-15-19-18-8(2)23-15)6-11(9-4-5-9)16-13(12)21(3)20-7/h6,9H,4-5H2,1-3H3,(H,17,19,22).
What are the key properties of 6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 328.40 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1,3-dimethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 31266028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).