N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide

C20H26N4O3S — CID 46978487

IUPACN-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide
SMILESCN1CCc2nc(NC(=O)COc3ccc(CN4CCOCC4)cc3)sc2C1
InChIInChI=1S/C20H26N4O3S/c1-23-7-6-17-18(13-23)28-20(21-17)22-19(25)14-27-16-4-2-15(3-5-16)12-24-8-10-26-11-9-24/h2-5H,6-14H2,1H3,(H,21,22,25)
InChIKeyZZGYLCVOYUMEEO-UHFFFAOYSA-N
MW402.52 g/mol
LogP1.98
Rot. Bonds6

About N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide

N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide (PubChem CID 46978487) has the molecular formula C20H26N4O3S and a molecular weight of 402.52 g/mol. Its IUPAC name is N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide
PubChem CID46978487
Molecular FormulaC20H26N4O3S
Molecular Weight402.52 g/mol
Exact Mass402.17
IUPAC NameN-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide
SMILESCN1CCc2nc(NC(=O)COc3ccc(CN4CCOCC4)cc3)sc2C1
InChIInChI=1S/C20H26N4O3S/c1-23-7-6-17-18(13-23)28-20(21-17)22-19(25)14-27-16-4-2-15(3-5-16)12-24-8-10-26-11-9-24/h2-5H,6-14H2,1H3,(H,21,22,25)
InChIKeyZZGYLCVOYUMEEO-UHFFFAOYSA-N
XLogP1.98
TPSA66.93 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.52
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-morpholin-4-ylacetamide
CID 110444203
2-(3-ethylphenoxy)-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 51172807
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-(3-methylphenoxy)acetamide
CID 51172739
2-(4-benzoylphenoxy)-N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 16547135
2-(2-methoxyphenoxy)-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 31246055
2-(2,4-dichlorophenoxy)-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 30544845
2-(4-methylphenoxy)-N-[6-(morpholin-4-ylmethyl)-1,3-benzothiazol-2-yl]acetamide
CID 108740895
N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-(4-methylphenoxy)acetamide
CID 90543617
2-amino-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 39177210
4-ethoxy-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;hydrochloride
CID 44827009
N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-(3-nitrophenoxy)acetamide
CID 46408316
N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-(2-propoxyphenoxy)acetamide
CID 4822529

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide?
The IUPAC name of N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide (CID 46978487) is N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide.
What is the SMILES notation for N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide?
The canonical SMILES for N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide is CN1CCc2nc(NC(=O)COc3ccc(CN4CCOCC4)cc3)sc2C1.
What is the InChIKey of N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide?
The InChIKey is ZZGYLCVOYUMEEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O3S/c1-23-7-6-17-18(13-23)28-20(21-17)22-19(25)14-27-16-4-2-15(3-5-16)12-24-8-10-26-11-9-24/h2-5H,6-14H2,1H3,(H,21,22,25).
What are the key properties of N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide?
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide has a molecular weight of 402.52 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-[4-(morpholin-4-ylmethyl)phenoxy]acetamide is sourced from PubChem (CID 46978487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).