2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide

C7H15F3N2-2 — CID 159511778

IUPAC2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide
SMILESCC(C)(C)C[NH-].[NH-]CC(F)(F)F
InChIInChI=1S/C5H12N.C2H3F3N/c1-5(2,3)4-6;3-2(4,5)1-6/h6H,4H2,1-3H3;6H,1H2/q2*-1
InChIKeyMARQXSJICKLXCT-UHFFFAOYSA-N
MW184.20 g/mol
LogP3.69
Rot. Bonds

About 2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide

2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide (PubChem CID 159511778) has the molecular formula C7H15F3N2-2 and a molecular weight of 184.20 g/mol. Its IUPAC name is 2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide.

Molecular Properties

Compound Name2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide
PubChem CID159511778
Molecular FormulaC7H15F3N2-2
Molecular Weight184.20 g/mol
Exact Mass184.12
IUPAC Name2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide
SMILESCC(C)(C)C[NH-].[NH-]CC(F)(F)F
InChIInChI=1S/C5H12N.C2H3F3N/c1-5(2,3)4-6;3-2(4,5)1-6/h6H,4H2,1-3H3;6H,1H2/q2*-1
InChIKeyMARQXSJICKLXCT-UHFFFAOYSA-N
XLogP3.69
TPSA47.60 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide?
The IUPAC name of 2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide (CID 159511778) is 2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide.
What is the SMILES notation for 2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide?
The canonical SMILES for 2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide is CC(C)(C)C[NH-].[NH-]CC(F)(F)F.
What is the InChIKey of 2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide?
The InChIKey is MARQXSJICKLXCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N.C2H3F3N/c1-5(2,3)4-6;3-2(4,5)1-6/h6H,4H2,1-3H3;6H,1H2/q2*-1.
What are the key properties of 2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide?
2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide has a molecular weight of 184.20 g/mol, XLogP of 3.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylpropylazanide;2,2,2-trifluoroethylazanide is sourced from PubChem (CID 159511778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).