N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide

C15H19N3O3S — CID 95137604

IUPACN-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide
SMILESCc1csc([C@@H]2CN(CC(=O)NCc3ccco3)CCO2)n1
InChIInChI=1S/C15H19N3O3S/c1-11-10-22-15(17-11)13-8-18(4-6-21-13)9-14(19)16-7-12-3-2-5-20-12/h2-3,5,10,13H,4,6-9H2,1H3,(H,16,19)/t13-/m0/s1
InChIKeyKPCRJQYUFJWVPG-ZDUSSCGKSA-N
MW321.40 g/mol
LogP1.73
Rot. Bonds5

About N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide

N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide (PubChem CID 95137604) has the molecular formula C15H19N3O3S and a molecular weight of 321.40 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide
PubChem CID95137604
Molecular FormulaC15H19N3O3S
Molecular Weight321.40 g/mol
Exact Mass321.11
IUPAC NameN-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide
SMILESCc1csc([C@@H]2CN(CC(=O)NCc3ccco3)CCO2)n1
InChIInChI=1S/C15H19N3O3S/c1-11-10-22-15(17-11)13-8-18(4-6-21-13)9-14(19)16-7-12-3-2-5-20-12/h2-3,5,10,13H,4,6-9H2,1H3,(H,16,19)/t13-/m0/s1
InChIKeyKPCRJQYUFJWVPG-ZDUSSCGKSA-N
XLogP1.73
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N-(furan-2-ylmethyl)acetamide
CID 95175805
N-(furan-2-ylmethyl)-2-[4-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-1-yl]acetamide
CID 71793804
(2S)-4-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 95136754
2-[2-(4-chlorophenyl)morpholin-4-yl]-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 55827797
N-(furan-2-ylmethyl)-2-[(3R)-3-hydroxypiperidin-1-yl]acetamide
CID 29231189
2-(3,4-dihydroxypyrrolidin-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 106672810
(2R)-4-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-2-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 95138390
N,N-dimethyl-3-[[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]methyl]benzamide
CID 95138708
2-[(3R)-3-aminopyrrolidin-1-yl]-N-(furan-2-ylmethyl)acetamide
CID 115301905
(1R)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]-1-phenylethanol
CID 95136891
N-[(5-methylthiophen-2-yl)methyl]-2-[2-(1,3-thiazol-2-yl)morpholin-4-yl]acetamide
CID 86775067
N-(furan-2-ylmethyl)-2-[2-[[methyl(pyridazin-3-yl)amino]methyl]morpholin-4-yl]acetamide
CID 71872660

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide (CID 95137604) is N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide is Cc1csc([C@@H]2CN(CC(=O)NCc3ccco3)CCO2)n1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide?
The InChIKey is KPCRJQYUFJWVPG-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H19N3O3S/c1-11-10-22-15(17-11)13-8-18(4-6-21-13)9-14(19)16-7-12-3-2-5-20-12/h2-3,5,10,13H,4,6-9H2,1H3,(H,16,19)/t13-/m0/s1.
What are the key properties of N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide?
N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide has a molecular weight of 321.40 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide is sourced from PubChem (CID 95137604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).