4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide

C18H17Cl2N3O — CID 91032719

IUPAC4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide
SMILESCC(C)(CNC(=O)c1cc2c(Cl)cc(Cl)cn2n1)c1ccccc1
InChIInChI=1S/C18H17Cl2N3O/c1-18(2,12-6-4-3-5-7-12)11-21-17(24)15-9-16-14(20)8-13(19)10-23(16)22-15/h3-10H,11H2,1-2H3,(H,21,24)
InChIKeySTWADLOTRGHPML-UHFFFAOYSA-N
MW362.26 g/mol
LogP4.35
Rot. Bonds4

About 4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide

4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide (PubChem CID 91032719) has the molecular formula C18H17Cl2N3O and a molecular weight of 362.26 g/mol. Its IUPAC name is 4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide
PubChem CID91032719
Molecular FormulaC18H17Cl2N3O
Molecular Weight362.26 g/mol
Exact Mass361.07
IUPAC Name4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide
SMILESCC(C)(CNC(=O)c1cc2c(Cl)cc(Cl)cn2n1)c1ccccc1
InChIInChI=1S/C18H17Cl2N3O/c1-18(2,12-6-4-3-5-7-12)11-21-17(24)15-9-16-14(20)8-13(19)10-23(16)22-15/h3-10H,11H2,1-2H3,(H,21,24)
InChIKeySTWADLOTRGHPML-UHFFFAOYSA-N
XLogP4.35
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.26
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-6-methyl-N-(2-methyl-2-phenylpropyl)pyridine-3-carboxamide
CID 81228566
N-(2-methyl-2-phenylpropyl)-2H-triazole-4-carboxamide
CID 47338743
N-(2-methyl-2-phenylpropyl)-1,3-thiazole-4-carboxamide
CID 62045664
5,6-dichloro-N-(2-methyl-2-phenylpropyl)pyridine-3-carboxamide
CID 60748585
5-amino-2-chloro-N-(2-methyl-2-phenylpropyl)benzamide
CID 61140358
5-methyl-N-(2-methyl-2-phenylpropyl)-1H-pyrazole-3-carboxamide
CID 47297607
3,4-dimethyl-N-(2-methyl-2-phenylpropyl)benzamide
CID 113090275
2-amino-3-chloro-N-(2-methyl-2-phenylpropyl)benzamide
CID 115540422
2-hydroxy-N-(2-methyl-2-phenylpropyl)acetamide
CID 115140248
4-chloro-3-(diethylsulfamoyl)-N-(2-methyl-2-phenylpropyl)benzamide
CID 39698452
2,4-dichloro-N-(2-hydroxy-2-phenylpropyl)benzamide
CID 111335243
(2-methyl-2-phenylpropyl)carbamothioic S-acid
CID 115170506

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide?
The IUPAC name of 4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide (CID 91032719) is 4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide.
What is the SMILES notation for 4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide?
The canonical SMILES for 4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide is CC(C)(CNC(=O)c1cc2c(Cl)cc(Cl)cn2n1)c1ccccc1.
What is the InChIKey of 4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide?
The InChIKey is STWADLOTRGHPML-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17Cl2N3O/c1-18(2,12-6-4-3-5-7-12)11-21-17(24)15-9-16-14(20)8-13(19)10-23(16)22-15/h3-10H,11H2,1-2H3,(H,21,24).
What are the key properties of 4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide?
4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide has a molecular weight of 362.26 g/mol, XLogP of 4.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-N-(2-methyl-2-phenylpropyl)pyrazolo[1,5-a]pyridine-2-carboxamide is sourced from PubChem (CID 91032719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).