1,2,2,2-tetrapropoxyethane-1,1-diamine

C14H32N2O4 — CID 140586071

IUPAC1,2,2,2-tetrapropoxyethane-1,1-diamine
SMILESCCCOC(N)(N)C(OCCC)(OCCC)OCCC
InChIInChI=1S/C14H32N2O4/c1-5-9-17-13(15,16)14(18-10-6-2,19-11-7-3)20-12-8-4/h5-12,15-16H2,1-4H3
InChIKeyNUOOZAIXHCTCAC-UHFFFAOYSA-N
MW292.42 g/mol
LogP1.92
Rot. Bonds13

About 1,2,2,2-tetrapropoxyethane-1,1-diamine

1,2,2,2-tetrapropoxyethane-1,1-diamine (PubChem CID 140586071) has the molecular formula C14H32N2O4 and a molecular weight of 292.42 g/mol. Its IUPAC name is 1,2,2,2-tetrapropoxyethane-1,1-diamine.

Molecular Properties

Compound Name1,2,2,2-tetrapropoxyethane-1,1-diamine
PubChem CID140586071
Molecular FormulaC14H32N2O4
Molecular Weight292.42 g/mol
Exact Mass292.24
IUPAC Name1,2,2,2-tetrapropoxyethane-1,1-diamine
SMILESCCCOC(N)(N)C(OCCC)(OCCC)OCCC
InChIInChI=1S/C14H32N2O4/c1-5-9-17-13(15,16)14(18-10-6-2,19-11-7-3)20-12-8-4/h5-12,15-16H2,1-4H3
InChIKeyNUOOZAIXHCTCAC-UHFFFAOYSA-N
XLogP1.92
TPSA88.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2,2,3-trimethyl-1-propoxybutane-1,1-diamine
CID 19813602
1-(1,1-dipropoxyethoxy)propane
CID 21433420
methane;tris(2-methyl-2-propoxypropane)
CID 160767059
1,1-dipropoxyethylsilane
CID 173115072
1,1-dichloro-1-propoxypropane
CID 87434594
2-[difluoro(propoxy)methyl]-1,1,1,2,3,3,3-heptafluoropropane
CID 22450708
1,1-dipropoxyethyl-[2-(1,1-dipropoxyethylsilyl)ethyl]silane
CID 173016785
1-butoxypropane-1,1-diamine
CID 87535027
2-methyl-2-propoxyhexane
CID 91043348
ethyl 2-hydroxy-2-propoxypropanoate
CID 100919605
2-propoxysilylethane-1,1,1-triamine
CID 175412053
10,10-dipropoxyicosane
CID 150666261

Frequently Asked Questions

What is the IUPAC name of 1,2,2,2-tetrapropoxyethane-1,1-diamine?
The IUPAC name of 1,2,2,2-tetrapropoxyethane-1,1-diamine (CID 140586071) is 1,2,2,2-tetrapropoxyethane-1,1-diamine.
What is the SMILES notation for 1,2,2,2-tetrapropoxyethane-1,1-diamine?
The canonical SMILES for 1,2,2,2-tetrapropoxyethane-1,1-diamine is CCCOC(N)(N)C(OCCC)(OCCC)OCCC.
What is the InChIKey of 1,2,2,2-tetrapropoxyethane-1,1-diamine?
The InChIKey is NUOOZAIXHCTCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2O4/c1-5-9-17-13(15,16)14(18-10-6-2,19-11-7-3)20-12-8-4/h5-12,15-16H2,1-4H3.
What are the key properties of 1,2,2,2-tetrapropoxyethane-1,1-diamine?
1,2,2,2-tetrapropoxyethane-1,1-diamine has a molecular weight of 292.42 g/mol, XLogP of 1.92, 13 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,2-tetrapropoxyethane-1,1-diamine is sourced from PubChem (CID 140586071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).