amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite

C13H31N3O2P- — CID 86640486

IUPACamino-[bis[di(propan-2-yl)amino]methoxy]phosphinite
SMILESCC(C)N(C(C)C)C(OP(N)[O-])N(C(C)C)C(C)C
InChIInChI=1S/C13H31N3O2P/c1-9(2)15(10(3)4)13(18-19(14)17)16(11(5)6)12(7)8/h9-13H,14H2,1-8H3/q-1
InChIKeyFOWVSCSXUZBNFT-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.07
Rot. Bonds8

About amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite

amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite (PubChem CID 86640486) has the molecular formula C13H31N3O2P- and a molecular weight of 292.38 g/mol. Its IUPAC name is amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite.

Molecular Properties

Compound Nameamino-[bis[di(propan-2-yl)amino]methoxy]phosphinite
PubChem CID86640486
Molecular FormulaC13H31N3O2P-
Molecular Weight292.38 g/mol
Exact Mass292.22
IUPAC Nameamino-[bis[di(propan-2-yl)amino]methoxy]phosphinite
SMILESCC(C)N(C(C)C)C(OP(N)[O-])N(C(C)C)C(C)C
InChIInChI=1S/C13H31N3O2P/c1-9(2)15(10(3)4)13(18-19(14)17)16(11(5)6)12(7)8/h9-13H,14H2,1-8H3/q-1
InChIKeyFOWVSCSXUZBNFT-UHFFFAOYSA-N
XLogP2.07
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

bis[di(propan-2-yl)amino]methyl phosphite
CID 131729699
1-chlorophosphanyloxy-N,N,N',N'-tetra(propan-2-yl)methanediamine
CID 139938439
N,N-di(propan-2-yl)propan-2-amine;hydrate
CID 173081552
N-[1-[1-[di(propan-2-yl)amino]ethoxy]ethyl]-N-propan-2-ylpropan-2-amine
CID 19822699
methyl(propan-2-yloxy)phosphinite
CID 18981685
sodium propan-2-yl phosphite
CID 21332940
N-[amino(chloro)phosphanyl]oxy-N-propan-2-ylpropan-2-amine
CID 87498471
(2S)-N,N-di(propan-2-yl)but-3-en-2-amine
CID 163439575
propan-2-yl hydrogen phosphite
CID 20501230
1-fluoro-N,N,N',N'-tetra(propan-2-yl)methanediamine
CID 139882033
1-[1-hydroxyethyl(propan-2-yl)amino]ethanol
CID 57090083
2-dioxidophosphanyl-1,1-di(propan-2-yl)hydrazine
CID 21195288

Frequently Asked Questions

What is the IUPAC name of amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite?
The IUPAC name of amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite (CID 86640486) is amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite.
What is the SMILES notation for amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite?
The canonical SMILES for amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite is CC(C)N(C(C)C)C(OP(N)[O-])N(C(C)C)C(C)C.
What is the InChIKey of amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite?
The InChIKey is FOWVSCSXUZBNFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H31N3O2P/c1-9(2)15(10(3)4)13(18-19(14)17)16(11(5)6)12(7)8/h9-13H,14H2,1-8H3/q-1.
What are the key properties of amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite?
amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite has a molecular weight of 292.38 g/mol, XLogP of 2.07, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for amino-[bis[di(propan-2-yl)amino]methoxy]phosphinite is sourced from PubChem (CID 86640486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).