2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide

C10H19F3N2O — CID 61264075

IUPAC2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCCCN(CC(F)(F)F)C(=O)C(C)(C)N
InChIInChI=1S/C10H19F3N2O/c1-4-5-6-15(7-10(11,12)13)8(16)9(2,3)14/h4-7,14H2,1-3H3
InChIKeyUGEHELRKQIJGJO-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.91
Rot. Bonds5

About 2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide

2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 61264075) has the molecular formula C10H19F3N2O and a molecular weight of 240.27 g/mol. Its IUPAC name is 2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID61264075
Molecular FormulaC10H19F3N2O
Molecular Weight240.27 g/mol
Exact Mass240.14
IUPAC Name2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCCCN(CC(F)(F)F)C(=O)C(C)(C)N
InChIInChI=1S/C10H19F3N2O/c1-4-5-6-15(7-10(11,12)13)8(16)9(2,3)14/h4-7,14H2,1-3H3
InChIKeyUGEHELRKQIJGJO-UHFFFAOYSA-N
XLogP1.91
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of 2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide (CID 61264075) is 2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for 2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for 2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide is CCCCN(CC(F)(F)F)C(=O)C(C)(C)N.
What is the InChIKey of 2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is UGEHELRKQIJGJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O/c1-4-5-6-15(7-10(11,12)13)8(16)9(2,3)14/h4-7,14H2,1-3H3.
What are the key properties of 2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 240.27 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-butyl-2-methyl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 61264075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).