N-bis(phenylmethoxy)phosphorylethanamine

C16H20NO3P — CID 44719403

IUPACN-bis(phenylmethoxy)phosphorylethanamine
SMILESCCNP(=O)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C16H20NO3P/c1-2-17-21(18,19-13-15-9-5-3-6-10-15)20-14-16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3,(H,17,18)
InChIKeyRVGINWYMBUPCLK-UHFFFAOYSA-N
MW305.31 g/mol
LogP4.14
Rot. Bonds8

About N-bis(phenylmethoxy)phosphorylethanamine

N-bis(phenylmethoxy)phosphorylethanamine (PubChem CID 44719403) has the molecular formula C16H20NO3P and a molecular weight of 305.31 g/mol. Its IUPAC name is N-bis(phenylmethoxy)phosphorylethanamine.

Molecular Properties

Compound NameN-bis(phenylmethoxy)phosphorylethanamine
PubChem CID44719403
Molecular FormulaC16H20NO3P
Molecular Weight305.31 g/mol
Exact Mass305.12
IUPAC NameN-bis(phenylmethoxy)phosphorylethanamine
SMILESCCNP(=O)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C16H20NO3P/c1-2-17-21(18,19-13-15-9-5-3-6-10-15)20-14-16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3,(H,17,18)
InChIKeyRVGINWYMBUPCLK-UHFFFAOYSA-N
XLogP4.14
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.31
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-bis(phenylmethoxy)phosphorylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Bis(benzyloxy)(diisopropylamino)phosphine
CID 196621
Dibenzyl diethylphosphoramidite
CID 5066231
Dibenzyl phosphite
CID 6334615
Dibenzyl benzylphosphoramidate
CID 275759
N-bis(phenylmethoxy)phosphorylcyclohexanamine
CID 345019
Phosphonic acid, methyl-, bis(phenylmethyl) ester
CID 10978723
Dibenzyl phosphoramidate
CID 227052
Dibenzyl N,N-dimethylphosphoramidite
CID 736298
Ammonium dibenzyl phosphate
CID 18763575
Dibenzyl isobutylphosphate
CID 14826850
N,N-diethylamidofluorophosphate benzyl ester
CID 129787253
[Ethoxy(1-phenylethenoxy)phosphoryl]methylbenzene
CID 11324093

Frequently Asked Questions

What is the IUPAC name of N-bis(phenylmethoxy)phosphorylethanamine?
The IUPAC name of N-bis(phenylmethoxy)phosphorylethanamine (CID 44719403) is N-bis(phenylmethoxy)phosphorylethanamine.
What is the SMILES notation for N-bis(phenylmethoxy)phosphorylethanamine?
The canonical SMILES for N-bis(phenylmethoxy)phosphorylethanamine is CCNP(=O)(OCc1ccccc1)OCc1ccccc1.
What is the InChIKey of N-bis(phenylmethoxy)phosphorylethanamine?
The InChIKey is RVGINWYMBUPCLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20NO3P/c1-2-17-21(18,19-13-15-9-5-3-6-10-15)20-14-16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3,(H,17,18).
What are the key properties of N-bis(phenylmethoxy)phosphorylethanamine?
N-bis(phenylmethoxy)phosphorylethanamine has a molecular weight of 305.31 g/mol, XLogP of 4.14, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-bis(phenylmethoxy)phosphorylethanamine is sourced from PubChem (CID 44719403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).