2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide

C10H17F3N2O — CID 79810672

IUPAC2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide
SMILESCN(CC1CCC1)C(=O)C(C)(N)C(F)(F)F
InChIInChI=1S/C10H17F3N2O/c1-9(14,10(11,12)13)8(16)15(2)6-7-4-3-5-7/h7H,3-6,14H2,1-2H3
InChIKeySSYVZXRXMIBGAA-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.52
Rot. Bonds3

About 2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide

2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide (PubChem CID 79810672) has the molecular formula C10H17F3N2O and a molecular weight of 238.25 g/mol. Its IUPAC name is 2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide.

Molecular Properties

Compound Name2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide
PubChem CID79810672
Molecular FormulaC10H17F3N2O
Molecular Weight238.25 g/mol
Exact Mass238.13
IUPAC Name2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide
SMILESCN(CC1CCC1)C(=O)C(C)(N)C(F)(F)F
InChIInChI=1S/C10H17F3N2O/c1-9(14,10(11,12)13)8(16)15(2)6-7-4-3-5-7/h7H,3-6,14H2,1-2H3
InChIKeySSYVZXRXMIBGAA-UHFFFAOYSA-N
XLogP1.52
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-3,3,3-trifluoro-N,2-dimethyl-N-(oxan-3-ylmethyl)propanamide
CID 79812018
3-amino-N-(cyclohexylmethyl)-N,2,2,3-tetramethylbutanamide
CID 65269620
2-amino-N-cyclopentyl-3,3,3-trifluoro-N,2-dimethylpropanamide
CID 79796879
2-amino-N-(cyclohexylmethyl)-2-ethyl-N-methylbutanamide
CID 79812390
4-amino-N-(cyclopentylmethyl)-N,2,2-trimethylbutanamide
CID 115157078
2-amino-N-cyclopentyl-N-ethyl-3,3,3-trifluoro-2-methylpropanamide
CID 79796711
2-amino-N-(cyclopentylmethyl)-N,2-dimethylpentanamide;hydrochloride
CID 119759251
1-(cyclobutylmethyl)-1-methylurea
CID 62860439
2-amino-N-cyclobutyl-3,3,3-trifluoro-N-(2-hydroxyethyl)-2-methylpropanamide
CID 102861935
2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-3,3,3-trifluoro-N,2-dimethylpropanamide
CID 79797261
2-amino-N-cyclopentyl-3,3,3-trifluoro-N-(2-hydroxyethyl)-2-methylpropanamide
CID 79806120
N-(cyclohexylmethyl)-N,2-dimethyl-2-(methylamino)propanamide
CID 62845802

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide?
The IUPAC name of 2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide (CID 79810672) is 2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide.
What is the SMILES notation for 2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide?
The canonical SMILES for 2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide is CN(CC1CCC1)C(=O)C(C)(N)C(F)(F)F.
What is the InChIKey of 2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide?
The InChIKey is SSYVZXRXMIBGAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O/c1-9(14,10(11,12)13)8(16)15(2)6-7-4-3-5-7/h7H,3-6,14H2,1-2H3.
What are the key properties of 2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide?
2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide has a molecular weight of 238.25 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclobutylmethyl)-3,3,3-trifluoro-N,2-dimethylpropanamide is sourced from PubChem (CID 79810672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).