(2E)-2-hydroxyimino-N-prop-2-enylpropanamide

C6H10N2O2 — CID 11008011

IUPAC(2E)-2-hydroxyimino-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)/C(C)=N/O
InChIInChI=1S/C6H10N2O2/c1-3-4-7-6(9)5(2)8-10/h3,10H,1,4H2,2H3,(H,7,9)/b8-5+
InChIKeySWBUHZWMFGEAMJ-VMPITWQZSA-N
MW142.16 g/mol
LogP0.14
Rot. Bonds3

About (2E)-2-hydroxyimino-N-prop-2-enylpropanamide

(2E)-2-hydroxyimino-N-prop-2-enylpropanamide (PubChem CID 11008011) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is (2E)-2-hydroxyimino-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name(2E)-2-hydroxyimino-N-prop-2-enylpropanamide
PubChem CID11008011
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name(2E)-2-hydroxyimino-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)/C(C)=N/O
InChIInChI=1S/C6H10N2O2/c1-3-4-7-6(9)5(2)8-10/h3,10H,1,4H2,2H3,(H,7,9)/b8-5+
InChIKeySWBUHZWMFGEAMJ-VMPITWQZSA-N
XLogP0.14
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2E)-2-hydroxyimino-N-prop-2-enylpropanamide?
The IUPAC name of (2E)-2-hydroxyimino-N-prop-2-enylpropanamide (CID 11008011) is (2E)-2-hydroxyimino-N-prop-2-enylpropanamide.
What is the SMILES notation for (2E)-2-hydroxyimino-N-prop-2-enylpropanamide?
The canonical SMILES for (2E)-2-hydroxyimino-N-prop-2-enylpropanamide is C=CCNC(=O)/C(C)=N/O.
What is the InChIKey of (2E)-2-hydroxyimino-N-prop-2-enylpropanamide?
The InChIKey is SWBUHZWMFGEAMJ-VMPITWQZSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-3-4-7-6(9)5(2)8-10/h3,10H,1,4H2,2H3,(H,7,9)/b8-5+.
What are the key properties of (2E)-2-hydroxyimino-N-prop-2-enylpropanamide?
(2E)-2-hydroxyimino-N-prop-2-enylpropanamide has a molecular weight of 142.16 g/mol, XLogP of 0.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-hydroxyimino-N-prop-2-enylpropanamide is sourced from PubChem (CID 11008011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).