N-Cyano-1-ethoxy-N-propan-2-YL-methanimidamide

HCID 243775

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Basic information

CAS: 6938-25-6
Standard SMILES: CCOC(=NC(C)C)NC#N
InChIKey: KWNIZJNUWSXNQJ-UHFFFAOYSA-N
Molecular formula: C7H13N3O
Average molar mass: 155.2 g/mol
Monoisotopic mass: 155.10586205

Names & identifiers

Preferred name: N-Cyano-1-ethoxy-N-propan-2-YL-methanimidamide
IUPAC: ethyl N-cyano-N'-propan-2-ylcarbamimidate

Names & synonyms

6938-25-6NSC53938DTXSID60989165NSC-53938Ethyl N'-cyano-N-propan-2-ylcarbamimidateDS-002477Ethyl N'-cyano-N-(propan-2-yl)carbamimidateN-CYANO-1-ETHOXY-N-PROPAN-2-YL-METHANIMIDAMIDE

Database identifiers

CAS: 6938-25-6
PubChem CID: 243775
DTXSID: DTXSID60989165

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 57.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 11
Formal charge: 0
Complexity: 177

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