2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide

C12H19F3N2O — CID 60687287

IUPAC2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C1CC1)N(CC(F)(F)F)C(=O)CNC1CC1
InChIInChI=1S/C12H19F3N2O/c1-8(9-2-3-9)17(7-12(13,14)15)11(18)6-16-10-4-5-10/h8-10,16H,2-7H2,1H3
InChIKeyBJZPXYDPTNMZAP-UHFFFAOYSA-N
MW264.29 g/mol
LogP1.93
Rot. Bonds6

About 2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide

2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 60687287) has the molecular formula C12H19F3N2O and a molecular weight of 264.29 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID60687287
Molecular FormulaC12H19F3N2O
Molecular Weight264.29 g/mol
Exact Mass264.14
IUPAC Name2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C1CC1)N(CC(F)(F)F)C(=O)CNC1CC1
InChIInChI=1S/C12H19F3N2O/c1-8(9-2-3-9)17(7-12(13,14)15)11(18)6-16-10-4-5-10/h8-10,16H,2-7H2,1H3
InChIKeyBJZPXYDPTNMZAP-UHFFFAOYSA-N
XLogP1.93
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide (CID 60687287) is 2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide is CC(C1CC1)N(CC(F)(F)F)C(=O)CNC1CC1.
What is the InChIKey of 2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is BJZPXYDPTNMZAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19F3N2O/c1-8(9-2-3-9)17(7-12(13,14)15)11(18)6-16-10-4-5-10/h8-10,16H,2-7H2,1H3.
What are the key properties of 2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide?
2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 264.29 g/mol, XLogP of 1.93, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 60687287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).