(Z)-N'-ethylbut-2-enediamide

C6H10N2O2 — CID 46940416

IUPAC(Z)-N'-ethylbut-2-enediamide
SMILESCCNC(=O)/C=C\C(N)=O
InChIInChI=1S/C6H10N2O2/c1-2-8-6(10)4-3-5(7)9/h3-4H,2H2,1H3,(H2,7,9)(H,8,10)/b4-3-
InChIKeyLMUKJAZFWLIKCI-ARJAWSKDSA-N
MW142.16 g/mol
LogP-0.84
Rot. Bonds3

About (Z)-N'-ethylbut-2-enediamide

(Z)-N'-ethylbut-2-enediamide (PubChem CID 46940416) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is (Z)-N'-ethylbut-2-enediamide.

Molecular Properties

Compound Name(Z)-N'-ethylbut-2-enediamide
PubChem CID46940416
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name(Z)-N'-ethylbut-2-enediamide
SMILESCCNC(=O)/C=C\C(N)=O
InChIInChI=1S/C6H10N2O2/c1-2-8-6(10)4-3-5(7)9/h3-4H,2H2,1H3,(H2,7,9)(H,8,10)/b4-3-
InChIKeyLMUKJAZFWLIKCI-ARJAWSKDSA-N
XLogP-0.84
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N'-ethylbut-2-enediamide?
The IUPAC name of (Z)-N'-ethylbut-2-enediamide (CID 46940416) is (Z)-N'-ethylbut-2-enediamide.
What is the SMILES notation for (Z)-N'-ethylbut-2-enediamide?
The canonical SMILES for (Z)-N'-ethylbut-2-enediamide is CCNC(=O)/C=C\C(N)=O.
What is the InChIKey of (Z)-N'-ethylbut-2-enediamide?
The InChIKey is LMUKJAZFWLIKCI-ARJAWSKDSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-2-8-6(10)4-3-5(7)9/h3-4H,2H2,1H3,(H2,7,9)(H,8,10)/b4-3-.
What are the key properties of (Z)-N'-ethylbut-2-enediamide?
(Z)-N'-ethylbut-2-enediamide has a molecular weight of 142.16 g/mol, XLogP of -0.84, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-ethylbut-2-enediamide is sourced from PubChem (CID 46940416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).