N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide

C13H15N3O3S — CID 2504910

IUPACN-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
SMILESO=C(COc1ncnc2sccc12)NC[C@H]1CCCO1
InChIInChI=1S/C13H15N3O3S/c17-11(14-6-9-2-1-4-18-9)7-19-12-10-3-5-20-13(10)16-8-15-12/h3,5,8-9H,1-2,4,6-7H2,(H,14,17)/t9-/m1/s1
InChIKeyTWOIIJSZHBLKCR-SECBINFHSA-N
MW293.35 g/mol
LogP1.37
Rot. Bonds5

About N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide

N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide (PubChem CID 2504910) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide.

Molecular Properties

Compound NameN-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
PubChem CID2504910
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC NameN-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
SMILESO=C(COc1ncnc2sccc12)NC[C@H]1CCCO1
InChIInChI=1S/C13H15N3O3S/c17-11(14-6-9-2-1-4-18-9)7-19-12-10-3-5-20-13(10)16-8-15-12/h3,5,8-9H,1-2,4,6-7H2,(H,14,17)/t9-/m1/s1
InChIKeyTWOIIJSZHBLKCR-SECBINFHSA-N
XLogP1.37
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[[(7R)-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]oxy]-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 7831232
N-(oxolan-2-ylmethyl)-3-(1,3-thiazol-2-yl)propanamide
CID 90013649
2-(3,4-dichlorophenoxy)-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 2419982
2-[4-(4-methyl-1,3-thiazol-2-yl)phenoxy]-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 9123141
N-[(2R)-3-methylbutan-2-yl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2536928
N-(oxolan-2-ylmethyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 18168439
N-[[(2S)-oxolan-2-yl]methyl]-3-thiophen-2-ylpropanamide
CID 93174433
N-(oxolan-2-ylmethyl)-2-(2-phenylphenoxy)acetamide
CID 18168438
2-[2-[2-oxo-2-(oxolan-2-ylmethylamino)ethoxy]phenyl]acetic acid
CID 80721764
2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 874788
[2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] pyridine-4-carboxylate
CID 7783951
2-(5,6-dimethylpyridazin-3-yl)oxy-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 95352905

Frequently Asked Questions

What is the IUPAC name of N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The IUPAC name of N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide (CID 2504910) is N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide.
What is the SMILES notation for N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The canonical SMILES for N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide is O=C(COc1ncnc2sccc12)NC[C@H]1CCCO1.
What is the InChIKey of N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
The InChIKey is TWOIIJSZHBLKCR-SECBINFHSA-N. The full InChI is InChI=1S/C13H15N3O3S/c17-11(14-6-9-2-1-4-18-9)7-19-12-10-3-5-20-13(10)16-8-15-12/h3,5,8-9H,1-2,4,6-7H2,(H,14,17)/t9-/m1/s1.
What are the key properties of N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide?
N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide has a molecular weight of 293.35 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R)-oxolan-2-yl]methyl]-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide is sourced from PubChem (CID 2504910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).