3-dipropoxyphosphoryl-N-methylpropanamide

C10H22NO4P — CID 88662399

IUPAC3-dipropoxyphosphoryl-N-methylpropanamide
SMILESCCCOP(=O)(CCC(=O)NC)OCCC
InChIInChI=1S/C10H22NO4P/c1-4-7-14-16(13,15-8-5-2)9-6-10(12)11-3/h4-9H2,1-3H3,(H,11,12)
InChIKeyCODJMOVXJUPJNM-UHFFFAOYSA-N
MW251.26 g/mol
LogP2.17
Rot. Bonds9

About 3-dipropoxyphosphoryl-N-methylpropanamide

3-dipropoxyphosphoryl-N-methylpropanamide (PubChem CID 88662399) has the molecular formula C10H22NO4P and a molecular weight of 251.26 g/mol. Its IUPAC name is 3-dipropoxyphosphoryl-N-methylpropanamide.

Molecular Properties

Compound Name3-dipropoxyphosphoryl-N-methylpropanamide
PubChem CID88662399
Molecular FormulaC10H22NO4P
Molecular Weight251.26 g/mol
Exact Mass251.13
IUPAC Name3-dipropoxyphosphoryl-N-methylpropanamide
SMILESCCCOP(=O)(CCC(=O)NC)OCCC
InChIInChI=1S/C10H22NO4P/c1-4-7-14-16(13,15-8-5-2)9-6-10(12)11-3/h4-9H2,1-3H3,(H,11,12)
InChIKeyCODJMOVXJUPJNM-UHFFFAOYSA-N
XLogP2.17
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.26
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-dipropoxyphosphorylpropanoic acid
CID 34250012
ethane;3-methoxy-N-methylpropanamide
CID 178014406
3-[bis(2-chloroethoxy)phosphoryl]-N-(hydroxymethyl)propanamide
CID 23323362
1,5-bis(diethoxyphosphoryl)pentan-3-one
CID 12030147
ethyl 3-didodecoxyphosphorylpropanoate
CID 87376118
3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide
CID 58019725
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-methylpropanamide
CID 129207576
N-methylheptacosanamide
CID 18175889
1-[methoxy(propyl)phosphoryl]oxypropane
CID 587089
dipropoxyphosphorylmethylphosphonic acid
CID 57255852
N-methylnonadecanamide
CID 2724821
N-methylundecanamide
CID 23297450

Frequently Asked Questions

What is the IUPAC name of 3-dipropoxyphosphoryl-N-methylpropanamide?
The IUPAC name of 3-dipropoxyphosphoryl-N-methylpropanamide (CID 88662399) is 3-dipropoxyphosphoryl-N-methylpropanamide.
What is the SMILES notation for 3-dipropoxyphosphoryl-N-methylpropanamide?
The canonical SMILES for 3-dipropoxyphosphoryl-N-methylpropanamide is CCCOP(=O)(CCC(=O)NC)OCCC.
What is the InChIKey of 3-dipropoxyphosphoryl-N-methylpropanamide?
The InChIKey is CODJMOVXJUPJNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22NO4P/c1-4-7-14-16(13,15-8-5-2)9-6-10(12)11-3/h4-9H2,1-3H3,(H,11,12).
What are the key properties of 3-dipropoxyphosphoryl-N-methylpropanamide?
3-dipropoxyphosphoryl-N-methylpropanamide has a molecular weight of 251.26 g/mol, XLogP of 2.17, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dipropoxyphosphoryl-N-methylpropanamide is sourced from PubChem (CID 88662399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).