N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide

C14H12N4O2 — CID 110864932

IUPACN-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide
SMILESCc1cc(OCC(=O)Nc2ccc(C#N)cc2)ncn1
InChIInChI=1S/C14H12N4O2/c1-10-6-14(17-9-16-10)20-8-13(19)18-12-4-2-11(7-15)3-5-12/h2-6,9H,8H2,1H3,(H,18,19)
InChIKeyHZRONSOTBNMEIE-UHFFFAOYSA-N
MW268.28 g/mol
LogP1.67
Rot. Bonds4

About N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide

N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide (PubChem CID 110864932) has the molecular formula C14H12N4O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide
PubChem CID110864932
Molecular FormulaC14H12N4O2
Molecular Weight268.28 g/mol
Exact Mass268.10
IUPAC NameN-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide
SMILESCc1cc(OCC(=O)Nc2ccc(C#N)cc2)ncn1
InChIInChI=1S/C14H12N4O2/c1-10-6-14(17-9-16-10)20-8-13(19)18-12-4-2-11(7-15)3-5-12/h2-6,9H,8H2,1H3,(H,18,19)
InChIKeyHZRONSOTBNMEIE-UHFFFAOYSA-N
XLogP1.67
TPSA87.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-cyanophenyl)-2-[4-(methylamino)phenoxy]acetamide
CID 61027849
2-(4-cyanophenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 8744068
N-(4-cyanophenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 7966728
[2-(4-cyanoanilino)-2-oxoethyl] propanoate
CID 7851425
2-(2-chloro-5-methylphenoxy)-N-(4-cyanophenyl)acetamide
CID 7642831
[2-(4-cyanoanilino)-2-oxoethyl] 5-methylpyrazine-2-carboxylate
CID 2356445
N-(4-bromophenyl)-2-(4-cyanophenoxy)acetamide
CID 7818711
N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide
CID 3903681
ethyl 4-[2-(4-cyanoanilino)-2-oxoethoxy]benzoate
CID 34569577
N-(4-cyanophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 921044
N,N'-bis(4-cyanophenyl)propanediamide
CID 108956949
2-(5-cyano-2-methylphenoxy)-N-phenylacetamide
CID 103760055

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide?
The IUPAC name of N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide (CID 110864932) is N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide.
What is the SMILES notation for N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide?
The canonical SMILES for N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide is Cc1cc(OCC(=O)Nc2ccc(C#N)cc2)ncn1.
What is the InChIKey of N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide?
The InChIKey is HZRONSOTBNMEIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O2/c1-10-6-14(17-9-16-10)20-8-13(19)18-12-4-2-11(7-15)3-5-12/h2-6,9H,8H2,1H3,(H,18,19).
What are the key properties of N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide?
N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide has a molecular weight of 268.28 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-2-(6-methylpyrimidin-4-yl)oxyacetamide is sourced from PubChem (CID 110864932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).