2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide

C10H19F3N2O2 — CID 66275717

IUPAC2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide
SMILESCC(C)NC(C)(COC(C)C(F)(F)F)C(N)=O
InChIInChI=1S/C10H19F3N2O2/c1-6(2)15-9(4,8(14)16)5-17-7(3)10(11,12)13/h6-7,15H,5H2,1-4H3,(H2,14,16)
InChIKeyHXOCTTJEZDRINU-UHFFFAOYSA-N
MW256.27 g/mol
LogP1.20
Rot. Bonds6

About 2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide

2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide (PubChem CID 66275717) has the molecular formula C10H19F3N2O2 and a molecular weight of 256.27 g/mol. Its IUPAC name is 2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide.

Molecular Properties

Compound Name2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide
PubChem CID66275717
Molecular FormulaC10H19F3N2O2
Molecular Weight256.27 g/mol
Exact Mass256.14
IUPAC Name2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide
SMILESCC(C)NC(C)(COC(C)C(F)(F)F)C(N)=O
InChIInChI=1S/C10H19F3N2O2/c1-6(2)15-9(4,8(14)16)5-17-7(3)10(11,12)13/h6-7,15H,5H2,1-4H3,(H2,14,16)
InChIKeyHXOCTTJEZDRINU-UHFFFAOYSA-N
XLogP1.20
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.27
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide?
The IUPAC name of 2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide (CID 66275717) is 2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide.
What is the SMILES notation for 2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide?
The canonical SMILES for 2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide is CC(C)NC(C)(COC(C)C(F)(F)F)C(N)=O.
What is the InChIKey of 2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide?
The InChIKey is HXOCTTJEZDRINU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O2/c1-6(2)15-9(4,8(14)16)5-17-7(3)10(11,12)13/h6-7,15H,5H2,1-4H3,(H2,14,16).
What are the key properties of 2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide?
2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide has a molecular weight of 256.27 g/mol, XLogP of 1.20, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(propan-2-ylamino)-3-(1,1,1-trifluoropropan-2-yloxy)propanamide is sourced from PubChem (CID 66275717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).