2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide

C10H14F6N2O2 — CID 102722847

IUPAC2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide
SMILESCNC(COC(C(F)(F)F)C(F)(F)F)(C(N)=O)C1CC1
InChIInChI=1S/C10H14F6N2O2/c1-18-8(7(17)19,5-2-3-5)4-20-6(9(11,12)13)10(14,15)16/h5-6,18H,2-4H2,1H3,(H2,17,19)
InChIKeyANESRWDTRAKVBF-UHFFFAOYSA-N
MW308.22 g/mol
LogP1.35
Rot. Bonds6

About 2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide

2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide (PubChem CID 102722847) has the molecular formula C10H14F6N2O2 and a molecular weight of 308.22 g/mol. Its IUPAC name is 2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide
PubChem CID102722847
Molecular FormulaC10H14F6N2O2
Molecular Weight308.22 g/mol
Exact Mass308.10
IUPAC Name2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide
SMILESCNC(COC(C(F)(F)F)C(F)(F)F)(C(N)=O)C1CC1
InChIInChI=1S/C10H14F6N2O2/c1-18-8(7(17)19,5-2-3-5)4-20-6(9(11,12)13)10(14,15)16/h5-6,18H,2-4H2,1H3,(H2,17,19)
InChIKeyANESRWDTRAKVBF-UHFFFAOYSA-N
XLogP1.35
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.22
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 114197296
2-cyclopropyl-2-(methylamino)-3-[methyl(propan-2-yl)amino]propanamide
CID 63908080
2-cyclopropyl-3-(3-hydroxypropylsulfanyl)-2-(methylamino)propanamide
CID 66128112
3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide
CID 102722798
methyl 2-cyclopropyl-3-(2,2-difluoroethoxy)-2-(methylamino)propanoate
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2-cyclopropyl-2-(methylamino)-3-pentylsulfanylpropanamide
CID 107755622
2-cyclopropyl-2-(methylamino)-3-(2-methyl-5-propan-2-ylphenoxy)propanamide
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2-cyclopropyl-2-(methylamino)-3-(2-methylsulfonylethylsulfanyl)propanamide
CID 63920078
3-[bis(3-methylbutyl)amino]-2-cyclopropyl-2-(methylamino)propanamide
CID 107871018
2-cyclopropyl-2-(methylamino)-3-[propan-2-yl(propyl)amino]propanamide
CID 63910696
methyl 2-cyclopropyl-2-(methylamino)-3-pentan-2-yloxypropanoate
CID 102984337
2-(cyclopropylamino)-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-methylbutanamide
CID 102722876

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide?
The IUPAC name of 2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide (CID 102722847) is 2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide.
What is the SMILES notation for 2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide?
The canonical SMILES for 2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide is CNC(COC(C(F)(F)F)C(F)(F)F)(C(N)=O)C1CC1.
What is the InChIKey of 2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide?
The InChIKey is ANESRWDTRAKVBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F6N2O2/c1-18-8(7(17)19,5-2-3-5)4-20-6(9(11,12)13)10(14,15)16/h5-6,18H,2-4H2,1H3,(H2,17,19).
What are the key properties of 2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide?
2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide has a molecular weight of 308.22 g/mol, XLogP of 1.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-(methylamino)propanamide is sourced from PubChem (CID 102722847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).