2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide

C11H19F3N2O2 — CID 113233536

IUPAC2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(NCCOCC1CC1)C(=O)NCC(F)(F)F
InChIInChI=1S/C11H19F3N2O2/c1-8(10(17)16-7-11(12,13)14)15-4-5-18-6-9-2-3-9/h8-9,15H,2-7H2,1H3,(H,16,17)
InChIKeyYZUHYTYGNYDHLW-UHFFFAOYSA-N
MW268.28 g/mol
LogP1.07
Rot. Bonds8

About 2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide

2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 113233536) has the molecular formula C11H19F3N2O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is 2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID113233536
Molecular FormulaC11H19F3N2O2
Molecular Weight268.28 g/mol
Exact Mass268.14
IUPAC Name2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(NCCOCC1CC1)C(=O)NCC(F)(F)F
InChIInChI=1S/C11H19F3N2O2/c1-8(10(17)16-7-11(12,13)14)15-4-5-18-6-9-2-3-9/h8-9,15H,2-7H2,1H3,(H,16,17)
InChIKeyYZUHYTYGNYDHLW-UHFFFAOYSA-N
XLogP1.07
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-butan-2-yl-2-[2-(cyclopropylmethoxy)ethylamino]propanamide
CID 113233538
2-[3-(2-hydroxyethoxy)propylamino]-N-(2,2,2-trifluoroethyl)propanamide
CID 106309732
2-[3-(cyclopropylmethoxy)propylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 103603891
2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 115574953
2-(oxolan-3-ylmethylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 115581038
2-(1-cyclobutylethylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 115713799
2-(cyclohex-3-en-1-ylmethylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 115587189
N-[3-(cyclopropylmethoxy)propyl]-2-methoxypropanamide
CID 115588529
(2S,3S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-3-methylpentanamide
CID 103833000
2-(pent-4-ynylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 103711244
2-(2-ethylsulfinylethylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 113494695
2-[[2-(methylamino)-2-oxoethyl]amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 115574816

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of 2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide (CID 113233536) is 2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for 2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for 2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide is CC(NCCOCC1CC1)C(=O)NCC(F)(F)F.
What is the InChIKey of 2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is YZUHYTYGNYDHLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O2/c1-8(10(17)16-7-11(12,13)14)15-4-5-18-6-9-2-3-9/h8-9,15H,2-7H2,1H3,(H,16,17).
What are the key properties of 2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide?
2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 268.28 g/mol, XLogP of 1.07, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopropylmethoxy)ethylamino]-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 113233536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).