1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine

C17H16F6N2 — CID 161199121

IUPAC1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine
SMILESCN(c1ccccc1)C(N(C)c1ccccc1)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C17H16F6N2/c1-24(13-9-5-3-6-10-13)15(16(18,19)20,17(21,22)23)25(2)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKeyUUSYNYDZROPXEZ-UHFFFAOYSA-N
MW362.32 g/mol
LogP5.08
Rot. Bonds4

About 1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine

1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine (PubChem CID 161199121) has the molecular formula C17H16F6N2 and a molecular weight of 362.32 g/mol. Its IUPAC name is 1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine.

Molecular Properties

Compound Name1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine
PubChem CID161199121
Molecular FormulaC17H16F6N2
Molecular Weight362.32 g/mol
Exact Mass362.12
IUPAC Name1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine
SMILESCN(c1ccccc1)C(N(C)c1ccccc1)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C17H16F6N2/c1-24(13-9-5-3-6-10-13)15(16(18,19)20,17(21,22)23)25(2)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKeyUUSYNYDZROPXEZ-UHFFFAOYSA-N
XLogP5.08
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.32
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine?
The IUPAC name of 1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine (CID 161199121) is 1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine.
What is the SMILES notation for 1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine?
The canonical SMILES for 1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine is CN(c1ccccc1)C(N(C)c1ccccc1)(C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine?
The InChIKey is UUSYNYDZROPXEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F6N2/c1-24(13-9-5-3-6-10-13)15(16(18,19)20,17(21,22)23)25(2)14-11-7-4-8-12-14/h3-12H,1-2H3.
What are the key properties of 1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine?
1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine has a molecular weight of 362.32 g/mol, XLogP of 5.08, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,3,3,3-hexafluoro-2-N,2-N'-dimethyl-2-N,2-N'-diphenylpropane-2,2-diamine is sourced from PubChem (CID 161199121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).