N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine

C16H20NO3P — CID 15250488

IUPACN-bis(phenylmethoxy)phosphoryl-N-methylmethanamine
SMILESCN(C)P(=O)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C16H20NO3P/c1-17(2)21(18,19-13-15-9-5-3-6-10-15)20-14-16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3
InChIKeyUWDQDRYHPMBMCS-UHFFFAOYSA-N
MW305.31 g/mol
LogP4.09
Rot. Bonds7

About N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine

N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine (PubChem CID 15250488) has the molecular formula C16H20NO3P and a molecular weight of 305.31 g/mol. Its IUPAC name is N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine.

Molecular Properties

Compound NameN-bis(phenylmethoxy)phosphoryl-N-methylmethanamine
PubChem CID15250488
Molecular FormulaC16H20NO3P
Molecular Weight305.31 g/mol
Exact Mass305.12
IUPAC NameN-bis(phenylmethoxy)phosphoryl-N-methylmethanamine
SMILESCN(C)P(=O)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C16H20NO3P/c1-17(2)21(18,19-13-15-9-5-3-6-10-15)20-14-16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3
InChIKeyUWDQDRYHPMBMCS-UHFFFAOYSA-N
XLogP4.09
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.31
LogP ≤ 54.09
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-bis(phenylmethoxy)phosphoryl-N-methylmethanamine?
The IUPAC name of N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine (CID 15250488) is N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine.
What is the SMILES notation for N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine?
The canonical SMILES for N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine is CN(C)P(=O)(OCc1ccccc1)OCc1ccccc1.
What is the InChIKey of N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine?
The InChIKey is UWDQDRYHPMBMCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20NO3P/c1-17(2)21(18,19-13-15-9-5-3-6-10-15)20-14-16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3.
What are the key properties of N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine?
N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine has a molecular weight of 305.31 g/mol, XLogP of 4.09, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-bis(phenylmethoxy)phosphoryl-N-methylmethanamine is sourced from PubChem (CID 15250488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).