N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide

C16H22N4O5S — CID 95888882

IUPACN-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide
SMILESCc1nc(CNC(=O)C[C@H]2COCCN2C(=O)CN2CCOC2=O)cs1
InChIInChI=1S/C16H22N4O5S/c1-11-18-12(10-26-11)7-17-14(21)6-13-9-24-4-3-20(13)15(22)8-19-2-5-25-16(19)23/h10,13H,2-9H2,1H3,(H,17,21)/t13-/m0/s1
InChIKeyIOKXRSGPEVVZFZ-ZDUSSCGKSA-N
MW382.44 g/mol
LogP0.14
Rot. Bonds6

About N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide

N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide (PubChem CID 95888882) has the molecular formula C16H22N4O5S and a molecular weight of 382.44 g/mol. Its IUPAC name is N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide.

Molecular Properties

Compound NameN-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide
PubChem CID95888882
Molecular FormulaC16H22N4O5S
Molecular Weight382.44 g/mol
Exact Mass382.13
IUPAC NameN-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide
SMILESCc1nc(CNC(=O)C[C@H]2COCCN2C(=O)CN2CCOC2=O)cs1
InChIInChI=1S/C16H22N4O5S/c1-11-18-12(10-26-11)7-17-14(21)6-13-9-24-4-3-20(13)15(22)8-19-2-5-25-16(19)23/h10,13H,2-9H2,1H3,(H,17,21)/t13-/m0/s1
InChIKeyIOKXRSGPEVVZFZ-ZDUSSCGKSA-N
XLogP0.14
TPSA101.07 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

(3R)-3-methyl-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]morpholine-4-carboxamide
CID 94052563
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 55866206
N-[(5-methylpyrazin-2-yl)methyl]-2-[(3S)-4-(2-pyridin-4-ylacetyl)morpholin-3-yl]acetamide
CID 95891518
2-[(3R)-4-[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]morpholin-3-yl]acetic acid
CID 129381156
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-piperidin-4-ylacetamide
CID 61284018
1-[(3S)-3-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-(2-methyl-1,3-thiazol-4-yl)ethanone
CID 124983270
2-[(3R)-4-[2-(3-hydroxyphenyl)acetyl]morpholin-3-yl]-N-(pyrimidin-4-ylmethyl)acetamide
CID 95893803
2-bromo-N-[(2-methyl-1,3-thiazol-4-yl)methyl]acetamide
CID 63680112
N-[(2-methyl-1,3-thiazol-4-yl)methyl]oxolan-3-amine
CID 63335816
2-[4-[2-(2-tert-butyl-1,3-thiazol-4-yl)acetyl]morpholin-3-yl]-1-phenylethanone
CID 75426197
2-(4-methylphenoxy)-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone
CID 131654980
2-[4-[2-(3-cyano-2-methylindol-1-yl)acetyl]morpholin-3-yl]-N-(2-fluoroethyl)acetamide
CID 56881773

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide?
The IUPAC name of N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide (CID 95888882) is N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide.
What is the SMILES notation for N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide?
The canonical SMILES for N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide is Cc1nc(CNC(=O)C[C@H]2COCCN2C(=O)CN2CCOC2=O)cs1.
What is the InChIKey of N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide?
The InChIKey is IOKXRSGPEVVZFZ-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H22N4O5S/c1-11-18-12(10-26-11)7-17-14(21)6-13-9-24-4-3-20(13)15(22)8-19-2-5-25-16(19)23/h10,13H,2-9H2,1H3,(H,17,21)/t13-/m0/s1.
What are the key properties of N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide?
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide has a molecular weight of 382.44 g/mol, XLogP of 0.14, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-[(3S)-4-[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]morpholin-3-yl]acetamide is sourced from PubChem (CID 95888882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).