6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

C20H23N5O2 — CID 16622212

IUPAC6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1cc(C)c(CNC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)c(=O)[nH]1
InChIInChI=1S/C20H23N5O2/c1-10-7-11(2)22-20(27)15(10)9-21-19(26)14-8-16(13-5-6-13)23-18-17(14)12(3)24-25(18)4/h7-8,13H,5-6,9H2,1-4H3,(H,21,26)(H,22,27)
InChIKeyIATWWBPUFUBIKN-UHFFFAOYSA-N
MW365.44 g/mol
LogP2.39
Rot. Bonds4

About 6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 16622212) has the molecular formula C20H23N5O2 and a molecular weight of 365.44 g/mol. Its IUPAC name is 6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID16622212
Molecular FormulaC20H23N5O2
Molecular Weight365.44 g/mol
Exact Mass365.19
IUPAC Name6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1cc(C)c(CNC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)c(=O)[nH]1
InChIInChI=1S/C20H23N5O2/c1-10-7-11(2)22-20(27)15(10)9-21-19(26)14-8-16(13-5-6-13)23-18-17(14)12(3)24-25(18)4/h7-8,13H,5-6,9H2,1-4H3,(H,21,26)(H,22,27)
InChIKeyIATWWBPUFUBIKN-UHFFFAOYSA-N
XLogP2.39
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 16622212) is 6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is Cc1cc(C)c(CNC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)c(=O)[nH]1.
What is the InChIKey of 6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is IATWWBPUFUBIKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2/c1-10-7-11(2)22-20(27)15(10)9-21-19(26)14-8-16(13-5-6-13)23-18-17(14)12(3)24-25(18)4/h7-8,13H,5-6,9H2,1-4H3,(H,21,26)(H,22,27).
What are the key properties of 6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 365.44 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 16622212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).