N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine

C5H12NO3P — CID 15655557

IUPACN,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine
SMILESCN(C)P1(=O)OCCCO1
InChIInChI=1S/C5H12NO3P/c1-6(2)10(7)8-4-3-5-9-10/h3-5H2,1-2H3
InChIKeyIUBJJRWCCRZDBF-UHFFFAOYSA-N
MW165.13 g/mol
LogP1.09
Rot. Bonds1

About N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine

N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine (PubChem CID 15655557) has the molecular formula C5H12NO3P and a molecular weight of 165.13 g/mol. Its IUPAC name is N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine
PubChem CID15655557
Molecular FormulaC5H12NO3P
Molecular Weight165.13 g/mol
Exact Mass165.06
IUPAC NameN,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine
SMILESCN(C)P1(=O)OCCCO1
InChIInChI=1S/C5H12NO3P/c1-6(2)10(7)8-4-3-5-9-10/h3-5H2,1-2H3
InChIKeyIUBJJRWCCRZDBF-UHFFFAOYSA-N
XLogP1.09
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.13
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine?
The IUPAC name of N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine (CID 15655557) is N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine.
What is the SMILES notation for N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine?
The canonical SMILES for N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine is CN(C)P1(=O)OCCCO1.
What is the InChIKey of N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine?
The InChIKey is IUBJJRWCCRZDBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12NO3P/c1-6(2)10(7)8-4-3-5-9-10/h3-5H2,1-2H3.
What are the key properties of N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine?
N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine has a molecular weight of 165.13 g/mol, XLogP of 1.09, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-amine is sourced from PubChem (CID 15655557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).