N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide

C12H19F3N2O — CID 78966256

IUPACN,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESO=C(CNCC(F)(F)F)N(CC1CC1)CC1CC1
InChIInChI=1S/C12H19F3N2O/c13-12(14,15)8-16-5-11(18)17(6-9-1-2-9)7-10-3-4-10/h9-10,16H,1-8H2
InChIKeyACCSJHCEVGWDOD-UHFFFAOYSA-N
MW264.29 g/mol
LogP1.79
Rot. Bonds7

About N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide

N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 78966256) has the molecular formula C12H19F3N2O and a molecular weight of 264.29 g/mol. Its IUPAC name is N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID78966256
Molecular FormulaC12H19F3N2O
Molecular Weight264.29 g/mol
Exact Mass264.14
IUPAC NameN,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESO=C(CNCC(F)(F)F)N(CC1CC1)CC1CC1
InChIInChI=1S/C12H19F3N2O/c13-12(14,15)8-16-5-11(18)17(6-9-1-2-9)7-10-3-4-10/h9-10,16H,1-8H2
InChIKeyACCSJHCEVGWDOD-UHFFFAOYSA-N
XLogP1.79
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide (CID 78966256) is N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide is O=C(CNCC(F)(F)F)N(CC1CC1)CC1CC1.
What is the InChIKey of N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is ACCSJHCEVGWDOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19F3N2O/c13-12(14,15)8-16-5-11(18)17(6-9-1-2-9)7-10-3-4-10/h9-10,16H,1-8H2.
What are the key properties of N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide?
N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 264.29 g/mol, XLogP of 1.79, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 78966256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).