2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide

C14H24F3N3O — CID 63910739

IUPAC2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide
SMILESCCCN(CC(F)(F)F)CC(NC1CC1)(C(N)=O)C1CC1
InChIInChI=1S/C14H24F3N3O/c1-2-7-20(9-14(15,16)17)8-13(12(18)21,10-3-4-10)19-11-5-6-11/h10-11,19H,2-9H2,1H3,(H2,18,21)
InChIKeyCTJJAXRXSXRLAZ-UHFFFAOYSA-N
MW307.36 g/mol
LogP1.65
Rot. Bonds9

About 2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide

2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide (PubChem CID 63910739) has the molecular formula C14H24F3N3O and a molecular weight of 307.36 g/mol. Its IUPAC name is 2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide.

Molecular Properties

Compound Name2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide
PubChem CID63910739
Molecular FormulaC14H24F3N3O
Molecular Weight307.36 g/mol
Exact Mass307.19
IUPAC Name2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide
SMILESCCCN(CC(F)(F)F)CC(NC1CC1)(C(N)=O)C1CC1
InChIInChI=1S/C14H24F3N3O/c1-2-7-20(9-14(15,16)17)8-13(12(18)21,10-3-4-10)19-11-5-6-11/h10-11,19H,2-9H2,1H3,(H2,18,21)
InChIKeyCTJJAXRXSXRLAZ-UHFFFAOYSA-N
XLogP1.65
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.36
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide?
The IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide (CID 63910739) is 2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide.
What is the SMILES notation for 2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide?
The canonical SMILES for 2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide is CCCN(CC(F)(F)F)CC(NC1CC1)(C(N)=O)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide?
The InChIKey is CTJJAXRXSXRLAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F3N3O/c1-2-7-20(9-14(15,16)17)8-13(12(18)21,10-3-4-10)19-11-5-6-11/h10-11,19H,2-9H2,1H3,(H2,18,21).
What are the key properties of 2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide?
2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide has a molecular weight of 307.36 g/mol, XLogP of 1.65, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propanamide is sourced from PubChem (CID 63910739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).