N-[1-[(E)-ethylideneamino]oxyethenyl]formamide

C5H8N2O2 — CID 143561704

IUPACN-[1-[(E)-ethylideneamino]oxyethenyl]formamide
SMILESC=C(NC=O)O/N=C/C
InChIInChI=1S/C5H8N2O2/c1-3-7-9-5(2)6-4-8/h3-4H,2H2,1H3,(H,6,8)/b7-3+
InChIKeyKEXQYBWMFLQHPJ-XVNBXDOJSA-N
MW128.13 g/mol
LogP0.23
Rot. Bonds4

About N-[1-[(E)-ethylideneamino]oxyethenyl]formamide

N-[1-[(E)-ethylideneamino]oxyethenyl]formamide (PubChem CID 143561704) has the molecular formula C5H8N2O2 and a molecular weight of 128.13 g/mol. Its IUPAC name is N-[1-[(E)-ethylideneamino]oxyethenyl]formamide.

Molecular Properties

Compound NameN-[1-[(E)-ethylideneamino]oxyethenyl]formamide
PubChem CID143561704
Molecular FormulaC5H8N2O2
Molecular Weight128.13 g/mol
Exact Mass128.06
IUPAC NameN-[1-[(E)-ethylideneamino]oxyethenyl]formamide
SMILESC=C(NC=O)O/N=C/C
InChIInChI=1S/C5H8N2O2/c1-3-7-9-5(2)6-4-8/h3-4H,2H2,1H3,(H,6,8)/b7-3+
InChIKeyKEXQYBWMFLQHPJ-XVNBXDOJSA-N
XLogP0.23
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(E)-ethylideneamino] carbamate
CID 141143420
N-(N'-butoxycarbamimidoyl)formamide
CID 135985100
[(E)-ethylideneamino] 2,2-dimethylpropanoate
CID 166590786
[(E)-ethylideneamino] N-[4-[[(E)-ethylideneamino]oxycarbonylamino]phenyl]carbamate
CID 141252091
(ethylideneamino) N-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)carbamate
CID 78146191
N-[C-methyl-N-[(Z)-prop-1-enyl]carbonimidoyl]formamide
CID 136593314
N-(N'-tert-butylcarbamimidoyl)formamide
CID 58320078
N-(N'-ethylcarbamimidoyl)formamide
CID 71416538
(ethylideneamino) hydrogen carbonate;pyridine
CID 174441096
[(E)-ethylideneamino] benzoate
CID 59571787
(ethylideneamino) tetradecanoate
CID 57011999
ethyl 3-formamidobut-3-enoate
CID 174451318

Frequently Asked Questions

What is the IUPAC name of N-[1-[(E)-ethylideneamino]oxyethenyl]formamide?
The IUPAC name of N-[1-[(E)-ethylideneamino]oxyethenyl]formamide (CID 143561704) is N-[1-[(E)-ethylideneamino]oxyethenyl]formamide.
What is the SMILES notation for N-[1-[(E)-ethylideneamino]oxyethenyl]formamide?
The canonical SMILES for N-[1-[(E)-ethylideneamino]oxyethenyl]formamide is C=C(NC=O)O/N=C/C.
What is the InChIKey of N-[1-[(E)-ethylideneamino]oxyethenyl]formamide?
The InChIKey is KEXQYBWMFLQHPJ-XVNBXDOJSA-N. The full InChI is InChI=1S/C5H8N2O2/c1-3-7-9-5(2)6-4-8/h3-4H,2H2,1H3,(H,6,8)/b7-3+.
What are the key properties of N-[1-[(E)-ethylideneamino]oxyethenyl]formamide?
N-[1-[(E)-ethylideneamino]oxyethenyl]formamide has a molecular weight of 128.13 g/mol, XLogP of 0.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(E)-ethylideneamino]oxyethenyl]formamide is sourced from PubChem (CID 143561704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).