N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C21H25N5O — CID 119442612

IUPACN,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N(C)C3CCNCC3)c12
InChIInChI=1S/C21H25N5O/c1-14-19-17(21(27)25(2)16-9-11-22-12-10-16)13-18(15-7-5-4-6-8-15)23-20(19)26(3)24-14/h4-8,13,16,22H,9-12H2,1-3H3
InChIKeyCTIXPUQHMHHSHR-UHFFFAOYSA-N
MW363.47 g/mol
LogP2.77
Rot. Bonds3

About N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide

N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 119442612) has the molecular formula C21H25N5O and a molecular weight of 363.47 g/mol. Its IUPAC name is N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID119442612
Molecular FormulaC21H25N5O
Molecular Weight363.47 g/mol
Exact Mass363.21
IUPAC NameN,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N(C)C3CCNCC3)c12
InChIInChI=1S/C21H25N5O/c1-14-19-17(21(27)25(2)16-9-11-22-12-10-16)13-18(15-7-5-4-6-8-15)23-20(19)26(3)24-14/h4-8,13,16,22H,9-12H2,1-3H3
InChIKeyCTIXPUQHMHHSHR-UHFFFAOYSA-N
XLogP2.77
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.47
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 119442612) is N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide is Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N(C)C3CCNCC3)c12.
What is the InChIKey of N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is CTIXPUQHMHHSHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O/c1-14-19-17(21(27)25(2)16-9-11-22-12-10-16)13-18(15-7-5-4-6-8-15)23-20(19)26(3)24-14/h4-8,13,16,22H,9-12H2,1-3H3.
What are the key properties of N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 363.47 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-6-phenyl-N-piperidin-4-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 119442612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).