(2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide

C11H25N2O4P3 — CID 58593531

IUPAC(2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide
SMILESCN1[C@@H](C[C@H](CCOP)C(=O)NOPP)COC1(C)C
InChIInChI=1S/C11H25N2O4P3/c1-11(2)13(3)9(7-15-11)6-8(4-5-16-18)10(14)12-17-20-19/h8-9,20H,4-7,18-19H2,1-3H3,(H,12,14)/t8-,9-/m0/s1
InChIKeyCXTBYLHWKJYLCM-IUCAKERBSA-N
MW342.25 g/mol
LogP1.69
Rot. Bonds8

About (2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide

(2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide (PubChem CID 58593531) has the molecular formula C11H25N2O4P3 and a molecular weight of 342.25 g/mol. Its IUPAC name is (2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide.

Molecular Properties

Compound Name(2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide
PubChem CID58593531
Molecular FormulaC11H25N2O4P3
Molecular Weight342.25 g/mol
Exact Mass342.10
IUPAC Name(2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide
SMILESCN1[C@@H](C[C@H](CCOP)C(=O)NOPP)COC1(C)C
InChIInChI=1S/C11H25N2O4P3/c1-11(2)13(3)9(7-15-11)6-8(4-5-16-18)10(14)12-17-20-19/h8-9,20H,4-7,18-19H2,1-3H3,(H,12,14)/t8-,9-/m0/s1
InChIKeyCXTBYLHWKJYLCM-IUCAKERBSA-N
XLogP1.69
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.25
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide?
The IUPAC name of (2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide (CID 58593531) is (2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide.
What is the SMILES notation for (2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide?
The canonical SMILES for (2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide is CN1[C@@H](C[C@H](CCOP)C(=O)NOPP)COC1(C)C.
What is the InChIKey of (2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide?
The InChIKey is CXTBYLHWKJYLCM-IUCAKERBSA-N. The full InChI is InChI=1S/C11H25N2O4P3/c1-11(2)13(3)9(7-15-11)6-8(4-5-16-18)10(14)12-17-20-19/h8-9,20H,4-7,18-19H2,1-3H3,(H,12,14)/t8-,9-/m0/s1.
What are the key properties of (2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide?
(2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide has a molecular weight of 342.25 g/mol, XLogP of 1.69, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(diphosphanyloxy)-4-phosphanyloxy-2-[[(4S)-2,2,3-trimethyl-1,3-oxazolidin-4-yl]methyl]butanamide is sourced from PubChem (CID 58593531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).