N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine

C7H15F3N2 — CID 61348373

IUPACN'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
SMILESCC(C)N(CCN)CC(F)(F)F
InChIInChI=1S/C7H15F3N2/c1-6(2)12(4-3-11)5-7(8,9)10/h6H,3-5,11H2,1-2H3
InChIKeyRUUBDVVBLWRRCC-UHFFFAOYSA-N
MW184.20 g/mol
LogP1.22
Rot. Bonds4

About N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine

N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine (PubChem CID 61348373) has the molecular formula C7H15F3N2 and a molecular weight of 184.20 g/mol. Its IUPAC name is N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
PubChem CID61348373
Molecular FormulaC7H15F3N2
Molecular Weight184.20 g/mol
Exact Mass184.12
IUPAC NameN'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
SMILESCC(C)N(CCN)CC(F)(F)F
InChIInChI=1S/C7H15F3N2/c1-6(2)12(4-3-11)5-7(8,9)10/h6H,3-5,11H2,1-2H3
InChIKeyRUUBDVVBLWRRCC-UHFFFAOYSA-N
XLogP1.22
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine?
The IUPAC name of N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine (CID 61348373) is N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine?
The canonical SMILES for N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine is CC(C)N(CCN)CC(F)(F)F.
What is the InChIKey of N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine?
The InChIKey is RUUBDVVBLWRRCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15F3N2/c1-6(2)12(4-3-11)5-7(8,9)10/h6H,3-5,11H2,1-2H3.
What are the key properties of N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine?
N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine has a molecular weight of 184.20 g/mol, XLogP of 1.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine is sourced from PubChem (CID 61348373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).