3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide

C26H26FN3O3 — CID 166973074

IUPAC3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide
SMILESCOc1ccccc1CNC(=O)c1ccc2c(-c3c(O)cccc3F)c(C)nn2c1C(C)C
InChIInChI=1S/C26H26FN3O3/c1-15(2)25-18(26(32)28-14-17-8-5-6-11-22(17)33-4)12-13-20-23(16(3)29-30(20)25)24-19(27)9-7-10-21(24)31/h5-13,15,31H,14H2,1-4H3,(H,28,32)
InChIKeySPMDORSSPRITIA-UHFFFAOYSA-N
MW447.51 g/mol
LogP5.22
Rot. Bonds6

About 3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide

3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide (PubChem CID 166973074) has the molecular formula C26H26FN3O3 and a molecular weight of 447.51 g/mol. Its IUPAC name is 3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide
PubChem CID166973074
Molecular FormulaC26H26FN3O3
Molecular Weight447.51 g/mol
Exact Mass447.20
IUPAC Name3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide
SMILESCOc1ccccc1CNC(=O)c1ccc2c(-c3c(O)cccc3F)c(C)nn2c1C(C)C
InChIInChI=1S/C26H26FN3O3/c1-15(2)25-18(26(32)28-14-17-8-5-6-11-22(17)33-4)12-13-20-23(16(3)29-30(20)25)24-19(27)9-7-10-21(24)31/h5-13,15,31H,14H2,1-4H3,(H,28,32)
InChIKeySPMDORSSPRITIA-UHFFFAOYSA-N
XLogP5.22
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500447.51
LogP ≤ 55.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2,6-difluorophenyl)-N-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide
CID 162773965
3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide
CID 82786350
3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide
CID 62648542
3-(2,6-difluorophenyl)-N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide
CID 166973079
2-(difluoromethoxy)-3-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 51143674
3-(2-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 50812843
N-[(2-fluorophenyl)methyl]-2,3-dimethoxybenzamide
CID 17068329
5-chloro-2-fluoro-N-[(2-methoxyphenyl)methyl]benzamide
CID 26586354
3-(2,6-difluorophenyl)-2-methyl-N-[4-(4-methylphenyl)oxan-4-yl]-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide
CID 162773884
5-fluoro-2-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 31069159
2,3-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912335
N-[(2-methoxyphenyl)methyl]-2-propan-2-yl-1,3-thiazole-4-carboxamide
CID 110694211

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide?
The IUPAC name of 3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide (CID 166973074) is 3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide.
What is the SMILES notation for 3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide?
The canonical SMILES for 3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide is COc1ccccc1CNC(=O)c1ccc2c(-c3c(O)cccc3F)c(C)nn2c1C(C)C.
What is the InChIKey of 3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide?
The InChIKey is SPMDORSSPRITIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26FN3O3/c1-15(2)25-18(26(32)28-14-17-8-5-6-11-22(17)33-4)12-13-20-23(16(3)29-30(20)25)24-19(27)9-7-10-21(24)31/h5-13,15,31H,14H2,1-4H3,(H,28,32).
What are the key properties of 3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide?
3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide has a molecular weight of 447.51 g/mol, XLogP of 5.22, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoro-6-hydroxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-methyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-6-carboxamide is sourced from PubChem (CID 166973074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).