4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide

C19H24F2N4O4S — CID 142524479

IUPAC4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide
SMILESCOc1ncc(C2CCOCC2)c2sc(NC(=O)N3CCC(O)(C(F)F)CC3)nc12
InChIInChI=1S/C19H24F2N4O4S/c1-28-15-13-14(12(10-22-15)11-2-8-29-9-3-11)30-17(23-13)24-18(26)25-6-4-19(27,5-7-25)16(20)21/h10-11,16,27H,2-9H2,1H3,(H,23,24,26)
InChIKeyRTPMHHQRZFZMTR-UHFFFAOYSA-N
MW442.49 g/mol
LogP3.22
Rot. Bonds4

About 4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide

4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide (PubChem CID 142524479) has the molecular formula C19H24F2N4O4S and a molecular weight of 442.49 g/mol. Its IUPAC name is 4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide
PubChem CID142524479
Molecular FormulaC19H24F2N4O4S
Molecular Weight442.49 g/mol
Exact Mass442.15
IUPAC Name4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide
SMILESCOc1ncc(C2CCOCC2)c2sc(NC(=O)N3CCC(O)(C(F)F)CC3)nc12
InChIInChI=1S/C19H24F2N4O4S/c1-28-15-13-14(12(10-22-15)11-2-8-29-9-3-11)30-17(23-13)24-18(26)25-6-4-19(27,5-7-25)16(20)21/h10-11,16,27H,2-9H2,1H3,(H,23,24,26)
InChIKeyRTPMHHQRZFZMTR-UHFFFAOYSA-N
XLogP3.22
TPSA96.81 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.49
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide with MolForge

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Related Compounds

4-hydroxy-N-(4-methoxy-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-4-methylpiperidine-1-carboxamide
CID 146652574
M1069 (free base)
CID 154659422
4'-Hydroxy-6-trifluoromethyl-3',4',5',6'-tetrahydro-2'h-[2,4']bipyridinyl-1'-carboxylic acid(7-methoxy-thiazolo[5,4-d]pyrimidin-2-yl)-amide
CID 24829958
4-Hydroxy-4-[3-(trifluoromethy)phenyl]piperidine-1-carboxylic acid (7-methoxy-thiazolo[5,4-b]pyridine-2-yl)-amide
CID 24830615
[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl] N-(7-methoxy-[1,3]thiazolo[5,4-b]pyridin-2-yl)carbamate
CID 87456625
N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]-4-(trifluoromethoxy)benzamide
CID 137462552
N-[7-(4-fluorophenyl)-4-methoxy-[1,3]thiazolo[4,5-c]pyridin-2-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
CID 142524358
N-[4-(difluoromethoxy)-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl]-4-hydroxy-4-methylpiperidine-1-carboxamide
CID 142524367
N-[7-(3-fluorophenyl)-4-methoxy-[1,3]thiazolo[4,5-c]pyridin-2-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
CID 142524371
N-(6-fluoro-4-methoxy-7-phenyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
CID 142524374
N-[7-(2-fluorophenyl)-4-methoxy-[1,3]thiazolo[4,5-c]pyridin-2-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
CID 142524391
(3S)-3-fluoro-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]pyrrolidine-1-carboxamide
CID 142524407

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide?
The IUPAC name of 4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide (CID 142524479) is 4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide.
What is the SMILES notation for 4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide?
The canonical SMILES for 4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide is COc1ncc(C2CCOCC2)c2sc(NC(=O)N3CCC(O)(C(F)F)CC3)nc12.
What is the InChIKey of 4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide?
The InChIKey is RTPMHHQRZFZMTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24F2N4O4S/c1-28-15-13-14(12(10-22-15)11-2-8-29-9-3-11)30-17(23-13)24-18(26)25-6-4-19(27,5-7-25)16(20)21/h10-11,16,27H,2-9H2,1H3,(H,23,24,26).
What are the key properties of 4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide?
4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide has a molecular weight of 442.49 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-4-hydroxy-N-[4-methoxy-7-(oxan-4-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]piperidine-1-carboxamide is sourced from PubChem (CID 142524479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).