2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide

C10H19F3N2O — CID 79791210

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

About 2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide

2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide (PubChem CID 79791210) has the molecular formula C10H19F3N2O and a molecular weight of 240.27 g/mol. Its IUPAC name is 2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide.

Molecular Properties

Compound Name2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide
PubChem CID79791210
Molecular FormulaC10H19F3N2O
Molecular Weight240.27 g/mol
Exact Mass240.14
IUPAC Name2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide
SMILESCCCN(CCC)C(=O)C(C)(N)C(F)(F)F
InChIInChI=1S/C10H19F3N2O/c1-4-6-15(7-5-2)8(16)9(3,14)10(11,12)13/h4-7,14H2,1-3H3
InChIKeyBOBAUGFFVRUODP-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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Related Compounds

2-amino-N-ethyl-3,3,3-trifluoro-2-methyl-N-propylpropanamide
CID 79796969
2-amino-N,N-dibutyl-3,3,3-trifluoro-2-methylpropanamide
CID 79796610
2-amino-3,3,3-trifluoro-N,N-bis(2-methoxyethyl)-2-methylpropanamide
CID 79796803
2,2-dimethyl-N,N-dipropylpropanamide;methane
CID 157106915
2-amino-N-[2-(dimethylamino)ethyl]-3,3,3-trifluoro-2-methyl-N-(2-methylpropyl)propanamide
CID 79805335
2-amino-N,N-dihexyl-2-methylpropanamide
CID 61265821
2-amino-N-(2-cyanoethyl)-3,3,3-trifluoro-2-methyl-N-(2-methylpropyl)propanamide
CID 79804815
3-chloro-2,2-dimethyl-N,N-dipropylpropanamide
CID 63680887
2-amino-1,1,1-trifluoro-2-methylpentadecan-3-one
CID 116593074
2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)-2-methylpropanamide
CID 79796983
2-amino-N-cyclopentyl-N-ethyl-3,3,3-trifluoro-2-methylpropanamide
CID 79796711
2-amino-3,3,3-trifluoro-2-methyl-N-propylpropanamide
CID 79789702

Frequently Asked Questions

What is the IUPAC name of 2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide?
The IUPAC name of 2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide (CID 79791210) is 2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide.
What is the SMILES notation for 2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide?
The canonical SMILES for 2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide is CCCN(CCC)C(=O)C(C)(N)C(F)(F)F.
What is the InChIKey of 2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide?
The InChIKey is BOBAUGFFVRUODP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O/c1-4-6-15(7-5-2)8(16)9(3,14)10(11,12)13/h4-7,14H2,1-3H3.
What are the key properties of 2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide?
2-amino-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide 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-3,3,3-trifluoro-2-methyl-N,N-dipropylpropanamide is sourced from PubChem (CID 79791210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).