2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C22H26N4O — CID 122188589

IUPAC2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1ccn2nc(C)c(C(=O)NCc3ccc(N4CCCCC4)cc3)c2c1
InChIInChI=1S/C22H26N4O/c1-16-10-13-26-20(14-16)21(17(2)24-26)22(27)23-15-18-6-8-19(9-7-18)25-11-4-3-5-12-25/h6-10,13-14H,3-5,11-12,15H2,1-2H3,(H,23,27)
InChIKeyLGAWDFYKTHLWNW-UHFFFAOYSA-N
MW362.48 g/mol
LogP3.87
Rot. Bonds4

About 2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide

2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 122188589) has the molecular formula C22H26N4O and a molecular weight of 362.48 g/mol. Its IUPAC name is 2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID122188589
Molecular FormulaC22H26N4O
Molecular Weight362.48 g/mol
Exact Mass362.21
IUPAC Name2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1ccn2nc(C)c(C(=O)NCc3ccc(N4CCCCC4)cc3)c2c1
InChIInChI=1S/C22H26N4O/c1-16-10-13-26-20(14-16)21(17(2)24-26)22(27)23-15-18-6-8-19(9-7-18)25-11-4-3-5-12-25/h6-10,13-14H,3-5,11-12,15H2,1-2H3,(H,23,27)
InChIKeyLGAWDFYKTHLWNW-UHFFFAOYSA-N
XLogP3.87
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.48
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

CID 3671
CID 3671
CID 24958200
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CID 24958198
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CID 68291752
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CID 117769575
CID 117769575
CID 9821511
CID 9821511
CID 9820664
CID 9820664
CID 16719862
CID 16719862
CID 16720208
CID 16720208
CID 23585102
CID 23585102
CID 23585245
CID 23585245
CID 25093327
CID 25093327

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 122188589) is 2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide is Cc1ccn2nc(C)c(C(=O)NCc3ccc(N4CCCCC4)cc3)c2c1.
What is the InChIKey of 2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is LGAWDFYKTHLWNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O/c1-16-10-13-26-20(14-16)21(17(2)24-26)22(27)23-15-18-6-8-19(9-7-18)25-11-4-3-5-12-25/h6-10,13-14H,3-5,11-12,15H2,1-2H3,(H,23,27).
What are the key properties of 2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 362.48 g/mol, XLogP of 3.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[(4-piperidin-1-ylphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 122188589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).