2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine

C10H19F3N2 — CID 114995006

IUPAC2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
SMILESCCN(CC(F)(F)F)C(C)(CN)C1CC1
InChIInChI=1S/C10H19F3N2/c1-3-15(7-10(11,12)13)9(2,6-14)8-4-5-8/h8H,3-7,14H2,1-2H3
InChIKeyOGOCMGFXMMFSEC-UHFFFAOYSA-N
MW224.27 g/mol
LogP2.00
Rot. Bonds5

About 2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine

2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine (PubChem CID 114995006) has the molecular formula C10H19F3N2 and a molecular weight of 224.27 g/mol. Its IUPAC name is 2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine.

Molecular Properties

Compound Name2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
PubChem CID114995006
Molecular FormulaC10H19F3N2
Molecular Weight224.27 g/mol
Exact Mass224.15
IUPAC Name2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
SMILESCCN(CC(F)(F)F)C(C)(CN)C1CC1
InChIInChI=1S/C10H19F3N2/c1-3-15(7-10(11,12)13)9(2,6-14)8-4-5-8/h8H,3-7,14H2,1-2H3
InChIKeyOGOCMGFXMMFSEC-UHFFFAOYSA-N
XLogP2.00
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine?
The IUPAC name of 2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine (CID 114995006) is 2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine.
What is the SMILES notation for 2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine?
The canonical SMILES for 2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine is CCN(CC(F)(F)F)C(C)(CN)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine?
The InChIKey is OGOCMGFXMMFSEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2/c1-3-15(7-10(11,12)13)9(2,6-14)8-4-5-8/h8H,3-7,14H2,1-2H3.
What are the key properties of 2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine?
2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine has a molecular weight of 224.27 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-N-ethyl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine is sourced from PubChem (CID 114995006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).