N-(2-phosphanylethyl)propanamide

C5H12NOP — CID 146644677

IUPACN-(2-phosphanylethyl)propanamide
SMILESCCC(=O)NCCP
InChIInChI=1S/C5H12NOP/c1-2-5(7)6-3-4-8/h2-4,8H2,1H3,(H,6,7)
InChIKeyFBGHOOKSNAUQIE-UHFFFAOYSA-N
MW133.13 g/mol
LogP0.39
Rot. Bonds3

About N-(2-phosphanylethyl)propanamide

N-(2-phosphanylethyl)propanamide (PubChem CID 146644677) has the molecular formula C5H12NOP and a molecular weight of 133.13 g/mol. Its IUPAC name is N-(2-phosphanylethyl)propanamide.

Molecular Properties

Compound NameN-(2-phosphanylethyl)propanamide
PubChem CID146644677
Molecular FormulaC5H12NOP
Molecular Weight133.13 g/mol
Exact Mass133.07
IUPAC NameN-(2-phosphanylethyl)propanamide
SMILESCCC(=O)NCCP
InChIInChI=1S/C5H12NOP/c1-2-5(7)6-3-4-8/h2-4,8H2,1H3,(H,6,7)
InChIKeyFBGHOOKSNAUQIE-UHFFFAOYSA-N
XLogP0.39
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.13
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(carbamoylamino)ethyl]propanamide
CID 78993883
N-(3-aminopropyl)propanamide
CID 21290277
N-[2-[2-[bis[2-(propanoylamino)ethyl]amino]ethyl-[2-(propanoylamino)ethyl]amino]ethyl]propanamide
CID 129308455
methyl N-[2-(propanoylamino)ethyl]carbamate
CID 108574125
N-(3-methylbut-3-enyl)propanamide
CID 89197899
N-[7-[(2-chloroacetyl)amino]heptyl]propanamide
CID 163838006
N-[2-(propanoylamino)ethyl]pentanamide
CID 108542545
molecular hydrogen;N-(3-oxopentyl)propanamide
CID 142546391
ethane;N-undecylpropanamide
CID 155706114
N-[2-(dimethylcarbamoylamino)ethyl]propanamide
CID 83117545
N-(3-propylsulfonylpropyl)propanamide
CID 146416714
N-(4-methylpentyl)propanamide
CID 54140551

Frequently Asked Questions

What is the IUPAC name of N-(2-phosphanylethyl)propanamide?
The IUPAC name of N-(2-phosphanylethyl)propanamide (CID 146644677) is N-(2-phosphanylethyl)propanamide.
What is the SMILES notation for N-(2-phosphanylethyl)propanamide?
The canonical SMILES for N-(2-phosphanylethyl)propanamide is CCC(=O)NCCP.
What is the InChIKey of N-(2-phosphanylethyl)propanamide?
The InChIKey is FBGHOOKSNAUQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12NOP/c1-2-5(7)6-3-4-8/h2-4,8H2,1H3,(H,6,7).
What are the key properties of N-(2-phosphanylethyl)propanamide?
N-(2-phosphanylethyl)propanamide has a molecular weight of 133.13 g/mol, XLogP of 0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phosphanylethyl)propanamide is sourced from PubChem (CID 146644677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).