N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide

C12H24F3N3O — CID 78924472

IUPACN-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCC(C)N(CCNC(=O)CNCC(F)(F)F)C(C)C
InChIInChI=1S/C12H24F3N3O/c1-9(2)18(10(3)4)6-5-17-11(19)7-16-8-12(13,14)15/h9-10,16H,5-8H2,1-4H3,(H,17,19)
InChIKeyKUALFTSTEJGWPD-UHFFFAOYSA-N
MW283.34 g/mol
LogP1.37
Rot. Bonds8

About N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide

N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 78924472) has the molecular formula C12H24F3N3O and a molecular weight of 283.34 g/mol. Its IUPAC name is N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID78924472
Molecular FormulaC12H24F3N3O
Molecular Weight283.34 g/mol
Exact Mass283.19
IUPAC NameN-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCC(C)N(CCNC(=O)CNCC(F)(F)F)C(C)C
InChIInChI=1S/C12H24F3N3O/c1-9(2)18(10(3)4)6-5-17-11(19)7-16-8-12(13,14)15/h9-10,16H,5-8H2,1-4H3,(H,17,19)
InChIKeyKUALFTSTEJGWPD-UHFFFAOYSA-N
XLogP1.37
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[di(propan-2-yl)amino]ethyl]-2-(2-methoxyethylamino)acetamide
CID 79282466
N-butyl-2-[2-[di(propan-2-yl)amino]ethylamino]acetamide
CID 60672606
N-ethyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 28595910
N-butan-2-yl-3-[[2-(2,2,2-trifluoroethylamino)acetyl]amino]propanamide
CID 78924288
N-(2-methylbutyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 79261008
N-[2-[di(propan-2-yl)amino]ethyl]-3-oxobutanamide
CID 18071565
N-carbamoyl-2-[2-[di(propan-2-yl)amino]ethylamino]acetamide
CID 28568651
N-[2-(dimethylamino)-4-methylpentyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78963004
2-[[2-(2,2,2-trifluoroethylamino)acetyl]amino]ethyl carbamate
CID 83210570
4-ethyl-6-[[2-(2,2,2-trifluoroethylamino)acetyl]amino]hexanoic acid
CID 79261708
2-(2,2,2-trifluoroethylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
CID 103726464
N-[(2R)-1-hydroxypropan-2-yl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 107218513

Frequently Asked Questions

What is the IUPAC name of N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide (CID 78924472) is N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide is CC(C)N(CCNC(=O)CNCC(F)(F)F)C(C)C.
What is the InChIKey of N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is KUALFTSTEJGWPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24F3N3O/c1-9(2)18(10(3)4)6-5-17-11(19)7-16-8-12(13,14)15/h9-10,16H,5-8H2,1-4H3,(H,17,19).
What are the key properties of N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide?
N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 283.34 g/mol, XLogP of 1.37, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[di(propan-2-yl)amino]ethyl]-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 78924472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).