N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine

C10H25NO4P2 — CID 603830

IUPACN-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine
SMILESCCOP(C)(=O)OP(C)(=O)N(C(C)C)C(C)C
InChIInChI=1S/C10H25NO4P2/c1-8-14-17(7,13)15-16(6,12)11(9(2)3)10(4)5/h9-10H,8H2,1-7H3
InChIKeyZCEISCXYYKXJBJ-UHFFFAOYSA-N
MW285.26 g/mol
LogP3.80
Rot. Bonds7

About N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine

N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine (PubChem CID 603830) has the molecular formula C10H25NO4P2 and a molecular weight of 285.26 g/mol. Its IUPAC name is N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine
PubChem CID603830
Molecular FormulaC10H25NO4P2
Molecular Weight285.26 g/mol
Exact Mass285.13
IUPAC NameN-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine
SMILESCCOP(C)(=O)OP(C)(=O)N(C(C)C)C(C)C
InChIInChI=1S/C10H25NO4P2/c1-8-14-17(7,13)15-16(6,12)11(9(2)3)10(4)5/h9-10H,8H2,1-7H3
InChIKeyZCEISCXYYKXJBJ-UHFFFAOYSA-N
XLogP3.80
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.26
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

O-ethyl-O'-(2-diisopropylaminoethyl)methylphosphonite
CID 51437
Diethyl methyl diethylamidodiphosphate
CID 12236
HC 4131
CID 11227
O-isopropyl N,N-diisopropylamidocyanophosphate
CID 129769150
Diethyl {[(diethoxyphosphorothioyl)(ethyl)amino]methyl}phosphonate
CID 3840360
Phosphonic acid, [[bis(1-methylethyl)amino]methyl]-, diethyl ester
CID 4489500
Tetraisopropylpyrophosphoric acid amide
CID 53795199
DI-Tert-butyl (((diisopropylamino)(methoxy)phosphanyl)methyl)phosphonate
CID 142470787
Propyl N,N-diisopropylphosphoramidocyanidate
CID 583940
O-(2-Diisopropylaminoethyl) methylphosphinic acid
CID 6329279
N-di(propan-2-yloxy)phosphoryl-N-propan-2-ylpropan-1-amine
CID 24741652
N-dipropoxyphosphoryl-N-propan-2-ylpropan-1-amine
CID 24741655

Frequently Asked Questions

What is the IUPAC name of N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine (CID 603830) is N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine is CCOP(C)(=O)OP(C)(=O)N(C(C)C)C(C)C.
What is the InChIKey of N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine?
The InChIKey is ZCEISCXYYKXJBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25NO4P2/c1-8-14-17(7,13)15-16(6,12)11(9(2)3)10(4)5/h9-10H,8H2,1-7H3.
What are the key properties of N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine?
N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine has a molecular weight of 285.26 g/mol, XLogP of 3.80, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[ethoxy(methyl)phosphoryl]oxy-methylphosphoryl]-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 603830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).