N-hydroxy-N-prop-2-enylpent-4-enamide

C8H13NO2 — CID 13128364

IUPACN-hydroxy-N-prop-2-enylpent-4-enamide
SMILESC=CCCC(=O)N(O)CC=C
InChIInChI=1S/C8H13NO2/c1-3-5-6-8(10)9(11)7-4-2/h3-4,11H,1-2,5-7H2
InChIKeyKDLKNUKSMQUCBQ-UHFFFAOYSA-N
MW155.20 g/mol
LogP1.36
Rot. Bonds5

About N-hydroxy-N-prop-2-enylpent-4-enamide

N-hydroxy-N-prop-2-enylpent-4-enamide (PubChem CID 13128364) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is N-hydroxy-N-prop-2-enylpent-4-enamide.

Molecular Properties

Compound NameN-hydroxy-N-prop-2-enylpent-4-enamide
PubChem CID13128364
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC NameN-hydroxy-N-prop-2-enylpent-4-enamide
SMILESC=CCCC(=O)N(O)CC=C
InChIInChI=1S/C8H13NO2/c1-3-5-6-8(10)9(11)7-4-2/h3-4,11H,1-2,5-7H2
InChIKeyKDLKNUKSMQUCBQ-UHFFFAOYSA-N
XLogP1.36
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 N-hydroxy-N-prop-2-enylpent-4-enamide?
The IUPAC name of N-hydroxy-N-prop-2-enylpent-4-enamide (CID 13128364) is N-hydroxy-N-prop-2-enylpent-4-enamide.
What is the SMILES notation for N-hydroxy-N-prop-2-enylpent-4-enamide?
The canonical SMILES for N-hydroxy-N-prop-2-enylpent-4-enamide is C=CCCC(=O)N(O)CC=C.
What is the InChIKey of N-hydroxy-N-prop-2-enylpent-4-enamide?
The InChIKey is KDLKNUKSMQUCBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-3-5-6-8(10)9(11)7-4-2/h3-4,11H,1-2,5-7H2.
What are the key properties of N-hydroxy-N-prop-2-enylpent-4-enamide?
N-hydroxy-N-prop-2-enylpent-4-enamide has a molecular weight of 155.20 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-prop-2-enylpent-4-enamide is sourced from PubChem (CID 13128364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).