1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol

C8H21NO4P2 — CID 54197886

IUPAC1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol
SMILESCOCC(O)CN(CCOP)CCOP
InChIInChI=1S/C8H21NO4P2/c1-11-7-8(10)6-9(2-4-12-14)3-5-13-15/h8,10H,2-7,14-15H2,1H3
InChIKeyPNDORHVYMUZXMO-UHFFFAOYSA-N
MW257.21 g/mol
LogP-0.09
Rot. Bonds10

About 1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol

1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol (PubChem CID 54197886) has the molecular formula C8H21NO4P2 and a molecular weight of 257.21 g/mol. Its IUPAC name is 1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol.

Molecular Properties

Compound Name1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol
PubChem CID54197886
Molecular FormulaC8H21NO4P2
Molecular Weight257.21 g/mol
Exact Mass257.09
IUPAC Name1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol
SMILESCOCC(O)CN(CCOP)CCOP
InChIInChI=1S/C8H21NO4P2/c1-11-7-8(10)6-9(2-4-12-14)3-5-13-15/h8,10H,2-7,14-15H2,1H3
InChIKeyPNDORHVYMUZXMO-UHFFFAOYSA-N
XLogP-0.09
TPSA51.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.21
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(2R)-1-[bis(2-methoxyethyl)amino]-3-propan-2-yloxypropan-2-ol
CID 95357959
1-[bis(2-methoxyethyl)amino]-3-propan-2-yloxypropan-2-ol
CID 60635415
1-[2-(dimethylamino)ethyl-propylamino]-3-methoxypropan-2-ol
CID 63929215
1-[2-methoxyethyl(3-methoxypropyl)amino]-3-propan-2-yloxypropan-2-ol
CID 61035306
1-[bis(2-methoxyethyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991830
3-[bis(2-methoxyethyl)amino]propane-1,2-diol
CID 78907099
1-[bis(2-methoxyethyl)amino]-3-butoxypropan-2-ol
CID 107263774
1-(2-methoxyethoxy)-3-[2-methoxyethyl(3-methoxypropyl)amino]propan-2-ol
CID 106991901
1-[but-3-enyl(propyl)amino]-3-methoxypropan-2-ol
CID 90250583
1-[(dimethylamino)methyl-propylamino]-3-methoxypropan-2-ol
CID 123595558
1-[bis(2-methoxyethyl)amino]-3-(methylamino)propan-2-ol
CID 61418429
1-[bis(2-methoxyethyl)amino]propan-2-ol
CID 59693413

Frequently Asked Questions

What is the IUPAC name of 1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol?
The IUPAC name of 1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol (CID 54197886) is 1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol.
What is the SMILES notation for 1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol?
The canonical SMILES for 1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol is COCC(O)CN(CCOP)CCOP.
What is the InChIKey of 1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol?
The InChIKey is PNDORHVYMUZXMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21NO4P2/c1-11-7-8(10)6-9(2-4-12-14)3-5-13-15/h8,10H,2-7,14-15H2,1H3.
What are the key properties of 1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol?
1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol has a molecular weight of 257.21 g/mol, XLogP of -0.09, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[bis(2-phosphanyloxyethyl)amino]-3-methoxypropan-2-ol is sourced from PubChem (CID 54197886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).