N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide

C8H14F3NO — CID 60770756

IUPACN-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCC(=O)N(CC(F)(F)F)C(C)C
InChIInChI=1S/C8H14F3NO/c1-4-7(13)12(6(2)3)5-8(9,10)11/h6H,4-5H2,1-3H3
InChIKeyMMUJTCZUJHBAPC-UHFFFAOYSA-N
MW197.20 g/mol
LogP2.20
Rot. Bonds3

About N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide

N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 60770756) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound NameN-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID60770756
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC NameN-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCC(=O)N(CC(F)(F)F)C(C)C
InChIInChI=1S/C8H14F3NO/c1-4-7(13)12(6(2)3)5-8(9,10)11/h6H,4-5H2,1-3H3
InChIKeyMMUJTCZUJHBAPC-UHFFFAOYSA-N
XLogP2.20
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-Dibutyl-2,2,3,3,4,4,4-heptafluorobutanamide
CID 617533
N,N-Diethyl-2,2,3,3,4,4,4-heptafluorobutanamide
CID 5051020
N,N-Diethyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 2748458
N,N-diethyl-2,2,3,3-tetrafluoropropanamide
CID 136233
N,N-Dibutyl-2,2,2-trifluoroacetamide
CID 307195
N-Methyl-N-n-butyltrifluoroacetamide
CID 587692
Acetic acid, trifluoro, N,N-dipropyl
CID 524010
N-methyl-N-(propan-2-yl)propanamide
CID 18968516
N-[5-(dimethylamino)pent-3-yn-2-yl]-2,2,2-trifluoro-N-methylacetamide
CID 14025461
N,N-Diethyl-2,3,3,3-tetrafluoropropionamide
CID 2774042
N,N-Diethyl-3,3,3-trifluoropropanamide
CID 14383591
N-cyclopentyl-2,2,2-trifluoro-N-methylacetamide
CID 63374781

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide (CID 60770756) is N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide is CCC(=O)N(CC(F)(F)F)C(C)C.
What is the InChIKey of N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is MMUJTCZUJHBAPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c1-4-7(13)12(6(2)3)5-8(9,10)11/h6H,4-5H2,1-3H3.
What are the key properties of N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide?
N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 197.20 g/mol, XLogP of 2.20, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 60770756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).