N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide

C18H14N4O3S — CID 2668978

IUPACN-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide
SMILESCc1cc(NC(=O)COc2ncnc3sc(-c4ccccc4)cc23)no1
InChIInChI=1S/C18H14N4O3S/c1-11-7-15(22-25-11)21-16(23)9-24-17-13-8-14(12-5-3-2-4-6-12)26-18(13)20-10-19-17/h2-8,10H,9H2,1H3,(H,21,22,23)
InChIKeyZBNQLMWYUCLGHB-UHFFFAOYSA-N
MW366.40 g/mol
LogP3.67
Rot. Bonds5

About N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide

N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide (PubChem CID 2668978) has the molecular formula C18H14N4O3S and a molecular weight of 366.40 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide
PubChem CID2668978
Molecular FormulaC18H14N4O3S
Molecular Weight366.40 g/mol
Exact Mass366.08
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide
SMILESCc1cc(NC(=O)COc2ncnc3sc(-c4ccccc4)cc23)no1
InChIInChI=1S/C18H14N4O3S/c1-11-7-15(22-25-11)21-16(23)9-24-17-13-8-14(12-5-3-2-4-6-12)26-18(13)20-10-19-17/h2-8,10H,9H2,1H3,(H,21,22,23)
InChIKeyZBNQLMWYUCLGHB-UHFFFAOYSA-N
XLogP3.67
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.40
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide with MolForge

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Related Compounds

3-methyl-2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethoxy]benzoic acid
CID 60910796
2-[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethoxy]phenyl]acetic acid
CID 80723767
ethyl 2-[(5-methyl-1,2-oxazol-3-yl)carbamothioylamino]-5-phenylthiophene-3-carboxylate
CID 19686994
2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide
CID 133367589
4-phenoxy-6-phenylthieno[2,3-d]pyrimidine
CID 2408628
2-(3-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 2632943
3-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethoxy]pyridine-4-carboxylic acid
CID 81445469
5-chloro-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxybenzamide
CID 9251131
N-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine
CID 4882445
N-(5-methyl-1,2-oxazol-3-yl)-3-[(2-phenoxyacetyl)amino]propanamide
CID 110370363
2-(2-formylphenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 7762657
2-[3-(aminomethyl)phenoxy]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 106485131

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide (CID 2668978) is N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide is Cc1cc(NC(=O)COc2ncnc3sc(-c4ccccc4)cc23)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide?
The InChIKey is ZBNQLMWYUCLGHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O3S/c1-11-7-15(22-25-11)21-16(23)9-24-17-13-8-14(12-5-3-2-4-6-12)26-18(13)20-10-19-17/h2-8,10H,9H2,1H3,(H,21,22,23).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide?
N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide has a molecular weight of 366.40 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide is sourced from PubChem (CID 2668978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).