N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide

C14H18N2O4S — CID 29038507

IUPACN-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide
SMILESCOC[C@@H](C)NC(=O)COCc1cc(-c2cccs2)on1
InChIInChI=1S/C14H18N2O4S/c1-10(7-18-2)15-14(17)9-19-8-11-6-12(20-16-11)13-4-3-5-21-13/h3-6,10H,7-9H2,1-2H3,(H,15,17)/t10-/m1/s1
InChIKeyXNNKHDVAEMSFHZ-SNVBAGLBSA-N
MW310.38 g/mol
LogP2.07
Rot. Bonds8

About N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide

N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide (PubChem CID 29038507) has the molecular formula C14H18N2O4S and a molecular weight of 310.38 g/mol. Its IUPAC name is N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide.

Molecular Properties

Compound NameN-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide
PubChem CID29038507
Molecular FormulaC14H18N2O4S
Molecular Weight310.38 g/mol
Exact Mass310.10
IUPAC NameN-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide
SMILESCOC[C@@H](C)NC(=O)COCc1cc(-c2cccs2)on1
InChIInChI=1S/C14H18N2O4S/c1-10(7-18-2)15-14(17)9-19-8-11-6-12(20-16-11)13-4-3-5-21-13/h3-6,10H,7-9H2,1-2H3,(H,15,17)/t10-/m1/s1
InChIKeyXNNKHDVAEMSFHZ-SNVBAGLBSA-N
XLogP2.07
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide?
The IUPAC name of N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide (CID 29038507) is N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide.
What is the SMILES notation for N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide?
The canonical SMILES for N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide is COC[C@@H](C)NC(=O)COCc1cc(-c2cccs2)on1.
What is the InChIKey of N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide?
The InChIKey is XNNKHDVAEMSFHZ-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H18N2O4S/c1-10(7-18-2)15-14(17)9-19-8-11-6-12(20-16-11)13-4-3-5-21-13/h3-6,10H,7-9H2,1-2H3,(H,15,17)/t10-/m1/s1.
What are the key properties of N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide?
N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide has a molecular weight of 310.38 g/mol, XLogP of 2.07, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-methoxypropan-2-yl]-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methoxy]acetamide is sourced from PubChem (CID 29038507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).