N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine

C9H22NO3P — CID 144853603

IUPACN-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine
SMILESCNCCOCCOCCOCCP
InChIInChI=1S/C9H22NO3P/c1-10-2-3-11-4-5-12-6-7-13-8-9-14/h10H,2-9,14H2,1H3
InChIKeyMDAOLJWYXXZQKU-UHFFFAOYSA-N
MW223.25 g/mol
LogP0.13
Rot. Bonds11

About N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine

N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine (PubChem CID 144853603) has the molecular formula C9H22NO3P and a molecular weight of 223.25 g/mol. Its IUPAC name is N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine.

Molecular Properties

Compound NameN-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine
PubChem CID144853603
Molecular FormulaC9H22NO3P
Molecular Weight223.25 g/mol
Exact Mass223.13
IUPAC NameN-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine
SMILESCNCCOCCOCCOCCP
InChIInChI=1S/C9H22NO3P/c1-10-2-3-11-4-5-12-6-7-13-8-9-14/h10H,2-9,14H2,1H3
InChIKeyMDAOLJWYXXZQKU-UHFFFAOYSA-N
XLogP0.13
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine?
The IUPAC name of N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine (CID 144853603) is N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine.
What is the SMILES notation for N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine?
The canonical SMILES for N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine is CNCCOCCOCCOCCP.
What is the InChIKey of N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine?
The InChIKey is MDAOLJWYXXZQKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22NO3P/c1-10-2-3-11-4-5-12-6-7-13-8-9-14/h10H,2-9,14H2,1H3.
What are the key properties of N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine?
N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine has a molecular weight of 223.25 g/mol, XLogP of 0.13, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-[2-(2-phosphanylethoxy)ethoxy]ethoxy]ethanamine is sourced from PubChem (CID 144853603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).