2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide

C17H21N3O2S — CID 125175454

IUPAC2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide
SMILESO=C(C[C@H]1CNCCO1)NCCc1nc(-c2ccccc2)cs1
InChIInChI=1S/C17H21N3O2S/c21-16(10-14-11-18-8-9-22-14)19-7-6-17-20-15(12-23-17)13-4-2-1-3-5-13/h1-5,12,14,18H,6-11H2,(H,19,21)/t14-/m0/s1
InChIKeyJGMNGVKVMYRANB-AWEZNQCLSA-N
MW331.44 g/mol
LogP1.85
Rot. Bonds6

About 2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide

2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide (PubChem CID 125175454) has the molecular formula C17H21N3O2S and a molecular weight of 331.44 g/mol. Its IUPAC name is 2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide
PubChem CID125175454
Molecular FormulaC17H21N3O2S
Molecular Weight331.44 g/mol
Exact Mass331.14
IUPAC Name2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide
SMILESO=C(C[C@H]1CNCCO1)NCCc1nc(-c2ccccc2)cs1
InChIInChI=1S/C17H21N3O2S/c21-16(10-14-11-18-8-9-22-14)19-7-6-17-20-15(12-23-17)13-4-2-1-3-5-13/h1-5,12,14,18H,6-11H2,(H,19,21)/t14-/m0/s1
InChIKeyJGMNGVKVMYRANB-AWEZNQCLSA-N
XLogP1.85
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.44
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-morpholin-2-yl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]acetamide
CID 118769258
2-morpholin-2-yl-N-(2-phenylethyl)acetamide
CID 66434342
N-[(2-benzyl-1,3-thiazol-4-yl)methyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 154906934
N-(1,3-benzothiazol-2-ylmethyl)-2-[(2R)-morpholin-2-yl]acetamide
CID 124515478
N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]-2-thiophen-2-ylacetamide
CID 110440328
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-2-[(2R)-morpholin-2-yl]acetamide
CID 125163664
N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide
CID 1497759
2-[(2S)-3-oxo-1-propan-2-ylpiperazin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide
CID 25381744
(3S)-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]oxolane-3-carboxamide
CID 124758437
3-(dimethylamino)-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]propanamide
CID 110442461
N-[2-(N-methylanilino)ethyl]-2-morpholin-2-ylacetamide;dihydrochloride
CID 119837655
3-(5-phenyl-1,3,4-oxadiazol-2-yl)-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]propanamide
CID 25386042

Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide (CID 125175454) is 2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide is O=C(C[C@H]1CNCCO1)NCCc1nc(-c2ccccc2)cs1.
What is the InChIKey of 2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide?
The InChIKey is JGMNGVKVMYRANB-AWEZNQCLSA-N. The full InChI is InChI=1S/C17H21N3O2S/c21-16(10-14-11-18-8-9-22-14)19-7-6-17-20-15(12-23-17)13-4-2-1-3-5-13/h1-5,12,14,18H,6-11H2,(H,19,21)/t14-/m0/s1.
What are the key properties of 2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide?
2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide has a molecular weight of 331.44 g/mol, XLogP of 1.85, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-morpholin-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 125175454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).