N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide

C12H13N3O3 — CID 121086734

IUPACN-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide
SMILESCc1ccnc(OCC(=O)NCc2ccco2)n1
InChIInChI=1S/C12H13N3O3/c1-9-4-5-13-12(15-9)18-8-11(16)14-7-10-3-2-6-17-10/h2-6H,7-8H2,1H3,(H,14,16)
InChIKeyOILATIKYDXGZKN-UHFFFAOYSA-N
MW247.25 g/mol
LogP1.07
Rot. Bonds5

About N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide

N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide (PubChem CID 121086734) has the molecular formula C12H13N3O3 and a molecular weight of 247.25 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide
PubChem CID121086734
Molecular FormulaC12H13N3O3
Molecular Weight247.25 g/mol
Exact Mass247.10
IUPAC NameN-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide
SMILESCc1ccnc(OCC(=O)NCc2ccco2)n1
InChIInChI=1S/C12H13N3O3/c1-9-4-5-13-12(15-9)18-8-11(16)14-7-10-3-2-6-17-10/h2-6H,7-8H2,1H3,(H,14,16)
InChIKeyOILATIKYDXGZKN-UHFFFAOYSA-N
XLogP1.07
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(furan-2-ylmethyl)-2-quinoxalin-6-yloxyacetamide
CID 51362583
N-(furan-2-ylmethyl)-2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetamide
CID 51208521
N-(furan-2-ylmethyl)-2-(7-methoxyquinolin-4-yl)oxyacetamide
CID 56795574
2-(3-ethoxyphenoxy)-N-(furan-2-ylmethyl)acetamide
CID 112977702
2-(4-chloro-3-methylphenoxy)-N-(furan-2-ylmethyl)acetamide
CID 692240
3-[2-(furan-2-ylmethylamino)-2-oxoethoxy]-2-methylbenzoic acid
CID 82810339
[2-(furan-2-ylmethylamino)-2-oxoethyl] 4-(5-methylpyrazol-1-yl)benzoate
CID 8552464
2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide
CID 9079933
2-(3-tert-butylphenoxy)-N-(furan-2-ylmethyl)acetamide
CID 51141583
N-(furan-2-ylmethyl)-2-[4-[(4-methoxyphenyl)sulfamoyl]phenoxy]acetamide
CID 126384368
2-(4-bromo-2-tert-butylphenoxy)-N-(furan-2-ylmethyl)acetamide
CID 7721428
2-[[2-(4-acetylphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide
CID 30039326

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide (CID 121086734) is N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide is Cc1ccnc(OCC(=O)NCc2ccco2)n1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide?
The InChIKey is OILATIKYDXGZKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O3/c1-9-4-5-13-12(15-9)18-8-11(16)14-7-10-3-2-6-17-10/h2-6H,7-8H2,1H3,(H,14,16).
What are the key properties of N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide?
N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide has a molecular weight of 247.25 g/mol, XLogP of 1.07, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-(4-methylpyrimidin-2-yl)oxyacetamide is sourced from PubChem (CID 121086734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).