2-phosphanyl-N-prop-2-enylacetamide

C5H10NOP — CID 88653876

IUPAC2-phosphanyl-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CP
InChIInChI=1S/C5H10NOP/c1-2-3-6-5(7)4-8/h2H,1,3-4,8H2,(H,6,7)
InChIKeyHNSVWAAGVQFQGU-UHFFFAOYSA-N
MW131.11 g/mol
LogP0.16
Rot. Bonds3

About 2-phosphanyl-N-prop-2-enylacetamide

2-phosphanyl-N-prop-2-enylacetamide (PubChem CID 88653876) has the molecular formula C5H10NOP and a molecular weight of 131.11 g/mol. Its IUPAC name is 2-phosphanyl-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-phosphanyl-N-prop-2-enylacetamide
PubChem CID88653876
Molecular FormulaC5H10NOP
Molecular Weight131.11 g/mol
Exact Mass131.05
IUPAC Name2-phosphanyl-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CP
InChIInChI=1S/C5H10NOP/c1-2-3-6-5(7)4-8/h2H,1,3-4,8H2,(H,6,7)
InChIKeyHNSVWAAGVQFQGU-UHFFFAOYSA-N
XLogP0.16
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.11
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-prop-2-enyl(113C)but-3-enamide
CID 173349564
4-oxo-4-(prop-2-enylamino)butanoic acid
CID 5157666
4-hydroxy-N-prop-2-enylbutanamide
CID 55286226
2-hydrazinyl-N-prop-2-enylacetamide
CID 83694224
2-(methylamino)-N-prop-2-enylacetamide;hydrochloride
CID 53410796
prop-2-enylcarbamic acid;hydrate
CID 173458484
N-prop-2-enyloctanamide
CID 4071942
molybdenum;hexakis(N-prop-2-enylcarbamothioate)
CID 173070392
N-prop-2-enyl-2-(propylamino)acetamide
CID 54819030
2-propan-2-yloxy-N-prop-2-enylacetamide
CID 112686662
N-(prop-2-enylcarbamoyl)but-3-enamide
CID 87949156
methanethiol;prop-2-enylcarbamic acid
CID 175464551

Frequently Asked Questions

What is the IUPAC name of 2-phosphanyl-N-prop-2-enylacetamide?
The IUPAC name of 2-phosphanyl-N-prop-2-enylacetamide (CID 88653876) is 2-phosphanyl-N-prop-2-enylacetamide.
What is the SMILES notation for 2-phosphanyl-N-prop-2-enylacetamide?
The canonical SMILES for 2-phosphanyl-N-prop-2-enylacetamide is C=CCNC(=O)CP.
What is the InChIKey of 2-phosphanyl-N-prop-2-enylacetamide?
The InChIKey is HNSVWAAGVQFQGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10NOP/c1-2-3-6-5(7)4-8/h2H,1,3-4,8H2,(H,6,7).
What are the key properties of 2-phosphanyl-N-prop-2-enylacetamide?
2-phosphanyl-N-prop-2-enylacetamide has a molecular weight of 131.11 g/mol, XLogP of 0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phosphanyl-N-prop-2-enylacetamide is sourced from PubChem (CID 88653876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).