N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine

C7H18NO3P — CID 523227

IUPACN-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine
SMILESCCOP(=O)(OC(C)C)N(C)C
InChIInChI=1S/C7H18NO3P/c1-6-10-12(9,8(4)5)11-7(2)3/h7H,6H2,1-5H3
InChIKeyVWONBITUNATGHP-UHFFFAOYSA-N
MW195.20 g/mol
LogP2.12
Rot. Bonds5

About N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine

N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine (PubChem CID 523227) has the molecular formula C7H18NO3P and a molecular weight of 195.20 g/mol. Its IUPAC name is N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine.

Molecular Properties

Compound NameN-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine
PubChem CID523227
Molecular FormulaC7H18NO3P
Molecular Weight195.20 g/mol
Exact Mass195.10
IUPAC NameN-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine
SMILESCCOP(=O)(OC(C)C)N(C)C
InChIInChI=1S/C7H18NO3P/c1-6-10-12(9,8(4)5)11-7(2)3/h7H,6H2,1-5H3
InChIKeyVWONBITUNATGHP-UHFFFAOYSA-N
XLogP2.12
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.20
LogP ≤ 52.12
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-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine?
The IUPAC name of N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine (CID 523227) is N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine.
What is the SMILES notation for N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine?
The canonical SMILES for N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine is CCOP(=O)(OC(C)C)N(C)C.
What is the InChIKey of N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine?
The InChIKey is VWONBITUNATGHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18NO3P/c1-6-10-12(9,8(4)5)11-7(2)3/h7H,6H2,1-5H3.
What are the key properties of N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine?
N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine has a molecular weight of 195.20 g/mol, XLogP of 2.12, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[ethoxy(propan-2-yloxy)phosphoryl]-N-methylmethanamine is sourced from PubChem (CID 523227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).