(2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide

C18H18F3N3O2 — CID 40794821

IUPAC(2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide
SMILESCCNC(=O)NC(=O)[C@H](Nc1cccc(C(F)(F)F)c1)c1ccccc1
InChIInChI=1S/C18H18F3N3O2/c1-2-22-17(26)24-16(25)15(12-7-4-3-5-8-12)23-14-10-6-9-13(11-14)18(19,20)21/h3-11,15,23H,2H2,1H3,(H2,22,24,25,26)/t15-/m1/s1
InChIKeyFMIDJOUHMBFEOM-OAHLLOKOSA-N
MW365.36 g/mol
LogP3.70
Rot. Bonds5

About (2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide

(2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide (PubChem CID 40794821) has the molecular formula C18H18F3N3O2 and a molecular weight of 365.36 g/mol. Its IUPAC name is (2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide.

Molecular Properties

Compound Name(2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide
PubChem CID40794821
Molecular FormulaC18H18F3N3O2
Molecular Weight365.36 g/mol
Exact Mass365.14
IUPAC Name(2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide
SMILESCCNC(=O)NC(=O)[C@H](Nc1cccc(C(F)(F)F)c1)c1ccccc1
InChIInChI=1S/C18H18F3N3O2/c1-2-22-17(26)24-16(25)15(12-7-4-3-5-8-12)23-14-10-6-9-13(11-14)18(19,20)21/h3-11,15,23H,2H2,1H3,(H2,22,24,25,26)/t15-/m1/s1
InChIKeyFMIDJOUHMBFEOM-OAHLLOKOSA-N
XLogP3.70
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.36
LogP ≤ 53.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl]amino]-N-methylbenzamide
CID 18086382
N-(ethylcarbamoyl)-2-(3-iodo-4-methylanilino)-2-phenylacetamide
CID 24561891
[(1R)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl] 3-(trifluoromethyl)benzoate
CID 7838955
ethyl N-[4-[[2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl]amino]phenyl]carbamate
CID 60542528
2-anilino-2-[3-(trifluoromethyl)phenyl]acetamide
CID 61005725
N-ethyl-N'-[3-(trifluoromethyl)phenyl]oxamide
CID 2251553
(2S)-N-(ethylcarbamoyl)-2-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide
CID 8595597
2-[4-(2-amino-2-oxoethoxy)anilino]-2-phenyl-N-[3-(trifluoromethyl)phenyl]acetamide
CID 55598567
1-(2-hydroxy-2-phenylethyl)-3-[3-(trifluoromethyl)phenyl]urea
CID 2812620
N-prop-2-ynyl-2-[3-(trifluoromethyl)anilino]propanamide
CID 43112941
(2R)-2-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-N-(ethylcarbamoyl)-2-phenylacetamide
CID 8599191
(2R)-2-[[(1R)-1-(3-chlorophenyl)ethyl]amino]-N-(ethylcarbamoyl)-2-phenylacetamide
CID 8599195

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide?
The IUPAC name of (2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide (CID 40794821) is (2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide.
What is the SMILES notation for (2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide?
The canonical SMILES for (2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide is CCNC(=O)NC(=O)[C@H](Nc1cccc(C(F)(F)F)c1)c1ccccc1.
What is the InChIKey of (2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide?
The InChIKey is FMIDJOUHMBFEOM-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H18F3N3O2/c1-2-22-17(26)24-16(25)15(12-7-4-3-5-8-12)23-14-10-6-9-13(11-14)18(19,20)21/h3-11,15,23H,2H2,1H3,(H2,22,24,25,26)/t15-/m1/s1.
What are the key properties of (2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide?
(2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide has a molecular weight of 365.36 g/mol, XLogP of 3.70, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(ethylcarbamoyl)-2-phenyl-2-[3-(trifluoromethyl)anilino]acetamide is sourced from PubChem (CID 40794821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).