N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide

C15H19F3N2O — CID 99820860

IUPACN-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide
SMILESC[C@@H](NCC(=O)N(C)C1CC1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H19F3N2O/c1-10(19-9-14(21)20(2)13-7-8-13)11-3-5-12(6-4-11)15(16,17)18/h3-6,10,13,19H,7-9H2,1-2H3/t10-/m1/s1
InChIKeyOOYYCFRSAHYHEO-SNVBAGLBSA-N
MW300.32 g/mol
LogP2.98
Rot. Bonds5

About N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide

N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide (PubChem CID 99820860) has the molecular formula C15H19F3N2O and a molecular weight of 300.32 g/mol. Its IUPAC name is N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide
PubChem CID99820860
Molecular FormulaC15H19F3N2O
Molecular Weight300.32 g/mol
Exact Mass300.14
IUPAC NameN-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide
SMILESC[C@@H](NCC(=O)N(C)C1CC1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H19F3N2O/c1-10(19-9-14(21)20(2)13-7-8-13)11-3-5-12(6-4-11)15(16,17)18/h3-6,10,13,19H,7-9H2,1-2H3/t10-/m1/s1
InChIKeyOOYYCFRSAHYHEO-SNVBAGLBSA-N
XLogP2.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-2-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]-N-methylacetamide
CID 81370950
N-cyclohexyl-N-methyl-2-(1-phenylethylamino)acetamide
CID 54815225
N-cyclopropyl-2-[1-(3-fluoro-4-methylsulfonylphenyl)ethylamino]-N-methylacetamide
CID 84598986
N-ethyl-2-[1-[4-(trifluoromethyl)phenyl]ethylamino]acetamide
CID 43566828
N-cyclopropyl-N-ethyl-2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]acetamide
CID 81347384
2-methyl-N-[1-[4-(trifluoromethyl)phenyl]ethyl]prop-2-en-1-amine
CID 115900097
N-cyclobutyl-N-methyl-2-(propan-2-ylamino)acetamide
CID 70337109
2-[1-(4-fluorophenyl)ethylamino]-N,N-dimethylacetamide
CID 43214641
2-methyl-N-[2-[1-[4-(trifluoromethyl)phenyl]ethylamino]ethyl]propanamide
CID 43103125
N-cyclopropyl-2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-methylacetamide
CID 54965170
2-(methylamino)-N-[1-[4-(trifluoromethyl)phenyl]ethyl]acetamide
CID 43711973
N-[4-[[1-[4-(trifluoromethyl)phenyl]ethylamino]methyl]phenyl]acetamide
CID 42955452

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide?
The IUPAC name of N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide (CID 99820860) is N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide.
What is the SMILES notation for N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide?
The canonical SMILES for N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide is C[C@@H](NCC(=O)N(C)C1CC1)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide?
The InChIKey is OOYYCFRSAHYHEO-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H19F3N2O/c1-10(19-9-14(21)20(2)13-7-8-13)11-3-5-12(6-4-11)15(16,17)18/h3-6,10,13,19H,7-9H2,1-2H3/t10-/m1/s1.
What are the key properties of N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide?
N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide has a molecular weight of 300.32 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-methyl-2-[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]acetamide is sourced from PubChem (CID 99820860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).