2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide

C26H32F3N5OS — CID 138670515

IUPAC2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide
SMILESCc1cc2c(C(=O)NC3CCC(CCN4CCc5sc(CCC(F)(F)F)nc5C4)CC3)cccn2n1
InChIInChI=1S/C26H32F3N5OS/c1-17-15-22-20(3-2-12-34(22)32-17)25(35)30-19-6-4-18(5-7-19)9-13-33-14-10-23-21(16-33)31-24(36-23)8-11-26(27,28)29/h2-3,12,15,18-19H,4-11,13-14,16H2,1H3,(H,30,35)
InChIKeyAIZLIBRJIVYBEU-UHFFFAOYSA-N
MW519.64 g/mol
LogP5.33
Rot. Bonds7

About 2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide

2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide (PubChem CID 138670515) has the molecular formula C26H32F3N5OS and a molecular weight of 519.64 g/mol. Its IUPAC name is 2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide
PubChem CID138670515
Molecular FormulaC26H32F3N5OS
Molecular Weight519.64 g/mol
Exact Mass519.23
IUPAC Name2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide
SMILESCc1cc2c(C(=O)NC3CCC(CCN4CCc5sc(CCC(F)(F)F)nc5C4)CC3)cccn2n1
InChIInChI=1S/C26H32F3N5OS/c1-17-15-22-20(3-2-12-34(22)32-17)25(35)30-19-6-4-18(5-7-19)9-13-33-14-10-23-21(16-33)31-24(36-23)8-11-26(27,28)29/h2-3,12,15,18-19H,4-11,13-14,16H2,1H3,(H,30,35)
InChIKeyAIZLIBRJIVYBEU-UHFFFAOYSA-N
XLogP5.33
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500519.64
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide with MolForge

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Related Compounds

2-(2-methyl-1,3-thiazol-5-yl)-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]acetamide
CID 138670784
N-[4-[2-[2-(2,2-difluoropropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]-2-methyl-1,3-benzothiazole-7-carboxamide
CID 138671460
N-[4-[2-[2-(2,2,2-trifluoroethoxy)-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepin-6-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 138671527
1-[(5-methyl-1,2-oxazol-3-yl)oxy]-3-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]propan-2-one
CID 159669864
N-[4-[2-[2-(2,2,2-trifluoroethoxy)-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepin-6-yl]ethyl]cyclohexyl]pyrrolo[1,2-b]pyridazine-5-carboxamide
CID 138671538
N-[4-[2-(2-cyclobutyl-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)ethyl]cyclohexyl]-2-methylindazole-4-carboxamide
CID 138670504
2-methyl-N-[(3S,6R)-6-[2-[2-(2,2,2-trifluoroethoxy)-5,6,8,9-tetrahydropyrido[2,3-d]azepin-7-yl]ethyl]oxan-3-yl]pyrazolo[1,5-a]pyridine-4-carboxamide
CID 138671187
N-[4-[2-[2-(2,2-difluoropropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]-1-methylindazole-6-carboxamide
CID 138671638
N-[4-[2-[2-(2,2-difluoropropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]-2,2-difluoro-1,3-benzodioxole-4-carboxamide
CID 138670821
2-methyl-N-[4-[2-[2-(2,2,2-trifluoroethoxy)-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepin-6-yl]ethyl]cyclohexyl]pyridine-3-carboxamide
CID 138671157
2-(1-methylpyrazol-4-yl)-N-[4-[2-[2-(trifluoromethoxymethyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]acetamide
CID 138671641
N-[4-[2-(2-methoxy-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl)ethyl]cyclohexyl]quinoline-5-carboxamide
CID 138671303

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide?
The IUPAC name of 2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide (CID 138670515) is 2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide.
What is the SMILES notation for 2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide?
The canonical SMILES for 2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide is Cc1cc2c(C(=O)NC3CCC(CCN4CCc5sc(CCC(F)(F)F)nc5C4)CC3)cccn2n1.
What is the InChIKey of 2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide?
The InChIKey is AIZLIBRJIVYBEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32F3N5OS/c1-17-15-22-20(3-2-12-34(22)32-17)25(35)30-19-6-4-18(5-7-19)9-13-33-14-10-23-21(16-33)31-24(36-23)8-11-26(27,28)29/h2-3,12,15,18-19H,4-11,13-14,16H2,1H3,(H,30,35).
What are the key properties of 2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide?
2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide has a molecular weight of 519.64 g/mol, XLogP of 5.33, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-[2-[2-(3,3,3-trifluoropropyl)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-5-yl]ethyl]cyclohexyl]pyrazolo[1,5-a]pyridine-4-carboxamide is sourced from PubChem (CID 138670515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).