2-(aminomethoxy)-N-(cyanomethyl)acetamide

C5H9N3O2 — CID 146237551

IUPAC2-(aminomethoxy)-N-(cyanomethyl)acetamide
SMILESN#CCNC(=O)COCN
InChIInChI=1S/C5H9N3O2/c6-1-2-8-5(9)3-10-4-7/h2-4,7H2,(H,8,9)
InChIKeyRDWOGLBOWZVTOE-UHFFFAOYSA-N
MW143.15 g/mol
LogP-1.44
Rot. Bonds4

About 2-(aminomethoxy)-N-(cyanomethyl)acetamide

2-(aminomethoxy)-N-(cyanomethyl)acetamide (PubChem CID 146237551) has the molecular formula C5H9N3O2 and a molecular weight of 143.15 g/mol. Its IUPAC name is 2-(aminomethoxy)-N-(cyanomethyl)acetamide.

Molecular Properties

Compound Name2-(aminomethoxy)-N-(cyanomethyl)acetamide
PubChem CID146237551
Molecular FormulaC5H9N3O2
Molecular Weight143.15 g/mol
Exact Mass143.07
IUPAC Name2-(aminomethoxy)-N-(cyanomethyl)acetamide
SMILESN#CCNC(=O)COCN
InChIInChI=1S/C5H9N3O2/c6-1-2-8-5(9)3-10-4-7/h2-4,7H2,(H,8,9)
InChIKeyRDWOGLBOWZVTOE-UHFFFAOYSA-N
XLogP-1.44
TPSA88.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.15
LogP ≤ 5-1.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cyanamide', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethoxy)-N-(cyanomethyl)acetamide?
The IUPAC name of 2-(aminomethoxy)-N-(cyanomethyl)acetamide (CID 146237551) is 2-(aminomethoxy)-N-(cyanomethyl)acetamide.
What is the SMILES notation for 2-(aminomethoxy)-N-(cyanomethyl)acetamide?
The canonical SMILES for 2-(aminomethoxy)-N-(cyanomethyl)acetamide is N#CCNC(=O)COCN.
What is the InChIKey of 2-(aminomethoxy)-N-(cyanomethyl)acetamide?
The InChIKey is RDWOGLBOWZVTOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O2/c6-1-2-8-5(9)3-10-4-7/h2-4,7H2,(H,8,9).
What are the key properties of 2-(aminomethoxy)-N-(cyanomethyl)acetamide?
2-(aminomethoxy)-N-(cyanomethyl)acetamide has a molecular weight of 143.15 g/mol, XLogP of -1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethoxy)-N-(cyanomethyl)acetamide is sourced from PubChem (CID 146237551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).