2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide

C14H14N4O2 — CID 79674698

IUPAC2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide
SMILESN#Cc1ccccc1NC(=O)CN1CCOC(C#N)C1
InChIInChI=1S/C14H14N4O2/c15-7-11-3-1-2-4-13(11)17-14(19)10-18-5-6-20-12(8-16)9-18/h1-4,12H,5-6,9-10H2,(H,17,19)
InChIKeyVZASUKKGVZQPDQ-UHFFFAOYSA-N
MW270.29 g/mol
LogP0.72
Rot. Bonds3

About 2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide

2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide (PubChem CID 79674698) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is 2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide.

Molecular Properties

Compound Name2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide
PubChem CID79674698
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC Name2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide
SMILESN#Cc1ccccc1NC(=O)CN1CCOC(C#N)C1
InChIInChI=1S/C14H14N4O2/c15-7-11-3-1-2-4-13(11)17-14(19)10-18-5-6-20-12(8-16)9-18/h1-4,12H,5-6,9-10H2,(H,17,19)
InChIKeyVZASUKKGVZQPDQ-UHFFFAOYSA-N
XLogP0.72
TPSA89.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-cyanophenyl)-2-(3-hydroxyazetidin-1-yl)acetamide
CID 63281967
N-(2-cyanophenyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 8930267
N-(4-amino-2-methoxyphenyl)-2-(2-cyanomorpholin-4-yl)acetamide
CID 79663611
methyl 1-[2-(2-cyanoanilino)-2-oxoethyl]pyrrolidine-3-carboxylate
CID 112731411
N-(5-amino-2-methoxyphenyl)-2-(2-cyanomorpholin-4-yl)acetamide
CID 79663165
1-[2-(2-cyanoanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 799678
2-[2-(aminomethyl)morpholin-4-yl]-N-(2-bromophenyl)acetamide
CID 114394940
N-(2-cyanophenyl)-2-(4-piperidin-1-ylpiperidin-1-yl)acetamide
CID 1439590
2-[4-(1-aminoethyl)piperidin-1-yl]-N-(2-cyanophenyl)acetamide
CID 63596583
2-(4-benzhydrylpiperazin-1-yl)-N-(2-cyanophenyl)acetamide
CID 2653850
2-[2-(aminomethyl)morpholin-4-yl]-N-(3-chloro-4-cyanophenyl)acetamide
CID 114398812
2-(2-methylmorpholin-4-yl)-N-(2-methylphenyl)acetamide
CID 51295683

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide?
The IUPAC name of 2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide (CID 79674698) is 2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide.
What is the SMILES notation for 2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide?
The canonical SMILES for 2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide is N#Cc1ccccc1NC(=O)CN1CCOC(C#N)C1.
What is the InChIKey of 2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide?
The InChIKey is VZASUKKGVZQPDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c15-7-11-3-1-2-4-13(11)17-14(19)10-18-5-6-20-12(8-16)9-18/h1-4,12H,5-6,9-10H2,(H,17,19).
What are the key properties of 2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide?
2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide has a molecular weight of 270.29 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanomorpholin-4-yl)-N-(2-cyanophenyl)acetamide is sourced from PubChem (CID 79674698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).