2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide

C12H23F3N2O — CID 55121532

IUPAC2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCNC(C)(C)C(=O)N(CC(C)C)CC(F)(F)F
InChIInChI=1S/C12H23F3N2O/c1-6-16-11(4,5)10(18)17(7-9(2)3)8-12(13,14)15/h9,16H,6-8H2,1-5H3
InChIKeyHSVMIUFQRCWPNX-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.42
Rot. Bonds6

About 2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide

2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 55121532) has the molecular formula C12H23F3N2O and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID55121532
Molecular FormulaC12H23F3N2O
Molecular Weight268.32 g/mol
Exact Mass268.18
IUPAC Name2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCNC(C)(C)C(=O)N(CC(C)C)CC(F)(F)F
InChIInChI=1S/C12H23F3N2O/c1-6-16-11(4,5)10(18)17(7-9(2)3)8-12(13,14)15/h9,16H,6-8H2,1-5H3
InChIKeyHSVMIUFQRCWPNX-UHFFFAOYSA-N
XLogP2.42
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of 2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide (CID 55121532) is 2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for 2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for 2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide is CCNC(C)(C)C(=O)N(CC(C)C)CC(F)(F)F.
What is the InChIKey of 2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is HSVMIUFQRCWPNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23F3N2O/c1-6-16-11(4,5)10(18)17(7-9(2)3)8-12(13,14)15/h9,16H,6-8H2,1-5H3.
What are the key properties of 2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide?
2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 268.32 g/mol, XLogP of 2.42, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-methyl-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 55121532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).