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

C19H26N4O4S — CID 86597284

IUPAC4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide
SMILESCOc1cnc(C2CCOCC2)c2sc(NC(=O)N3CCC(CO)CC3)nc12
InChIInChI=1S/C19H26N4O4S/c1-26-14-10-20-15(13-4-8-27-9-5-13)17-16(14)21-18(28-17)22-19(25)23-6-2-12(11-24)3-7-23/h10,12-13,24H,2-9,11H2,1H3,(H,21,22,25)
InChIKeyCBDKATAPXWAZHP-UHFFFAOYSA-N
MW406.51 g/mol
LogP2.83
Rot. Bonds4

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

4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide (PubChem CID 86597284) has the molecular formula C19H26N4O4S and a molecular weight of 406.51 g/mol. Its IUPAC name is 4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide
PubChem CID86597284
Molecular FormulaC19H26N4O4S
Molecular Weight406.51 g/mol
Exact Mass406.17
IUPAC Name4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide
SMILESCOc1cnc(C2CCOCC2)c2sc(NC(=O)N3CCC(CO)CC3)nc12
InChIInChI=1S/C19H26N4O4S/c1-26-14-10-20-15(13-4-8-27-9-5-13)17-16(14)21-18(28-17)22-19(25)23-6-2-12(11-24)3-7-23/h10,12-13,24H,2-9,11H2,1H3,(H,21,22,25)
InChIKeyCBDKATAPXWAZHP-UHFFFAOYSA-N
XLogP2.83
TPSA96.81 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.51
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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

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Related Compounds

4-hydroxy-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide
CID 142681404
4-[4-methoxy-2-(morpholine-4-carbonylamino)-1,3-benzothiazol-7-yl]piperidine-1-carboxylic acid
CID 22719552
4-(18F)fluoro-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)piperidine-1-carboxamide
CID 162675230
N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]morpholine-4-carboxamide
CID 11326842
N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)morpholine-4-carboxamide
CID 10155956
2-methoxy-N-(7-methoxy-4-morpholin-4-yl-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 86597252
4-(hydroxymethyl)-N-(7-methoxy-4-morpholin-4-yl-5,6-dihydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)piperidine-1-carboxamide
CID 164738779
N-[4-methoxy-7-(oxan-4-yl)-1,3-benzothiazol-2-yl]-2-(oxan-4-yl)acetamide
CID 11257802
(7-methoxy-4-morpholin-4-yl-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamic acid
CID 154342872
N-[7-(1,4-dioxepan-6-yl)-4-methoxy-1,3-benzothiazol-2-yl]piperidine-1-carboxamide
CID 11303889
4-hydroxy-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-4-methylpiperidine-1-carboxamide
CID 11618368
N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)-4-(hydroxymethyl)piperidine-1-carboxamide
CID 111475847

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide?
The IUPAC name of 4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide (CID 86597284) is 4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide.
What is the SMILES notation for 4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide?
The canonical SMILES for 4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide is COc1cnc(C2CCOCC2)c2sc(NC(=O)N3CCC(CO)CC3)nc12.
What is the InChIKey of 4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide?
The InChIKey is CBDKATAPXWAZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O4S/c1-26-14-10-20-15(13-4-8-27-9-5-13)17-16(14)21-18(28-17)22-19(25)23-6-2-12(11-24)3-7-23/h10,12-13,24H,2-9,11H2,1H3,(H,21,22,25).
What are the key properties of 4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide?
4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide has a molecular weight of 406.51 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-N-[7-methoxy-4-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridin-2-yl]piperidine-1-carboxamide is sourced from PubChem (CID 86597284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).