3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide

C19H20F3NO — CID 175774255

IUPAC3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide
SMILESCC(CCc1ccccc1)CC(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C19H20F3NO/c1-14(7-8-15-5-3-2-4-6-15)13-18(24)23-17-11-9-16(10-12-17)19(20,21)22/h2-6,9-12,14H,7-8,13H2,1H3,(H,23,24)
InChIKeyZNLAYLDINIKIEN-UHFFFAOYSA-N
MW335.37 g/mol
LogP5.30
Rot. Bonds6

About 3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide

3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide (PubChem CID 175774255) has the molecular formula C19H20F3NO and a molecular weight of 335.37 g/mol. Its IUPAC name is 3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide.

Molecular Properties

Compound Name3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide
PubChem CID175774255
Molecular FormulaC19H20F3NO
Molecular Weight335.37 g/mol
Exact Mass335.15
IUPAC Name3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide
SMILESCC(CCc1ccccc1)CC(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C19H20F3NO/c1-14(7-8-15-5-3-2-4-6-15)13-18(24)23-17-11-9-16(10-12-17)19(20,21)22/h2-6,9-12,14H,7-8,13H2,1H3,(H,23,24)
InChIKeyZNLAYLDINIKIEN-UHFFFAOYSA-N
XLogP5.30
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.37
LogP ≤ 55.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3S)-3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)-5-phenylpentanamide
CID 97315292
N-[4-(3-amino-3-oxopropoxy)phenyl]-3-methyl-5-phenylpentanamide
CID 86866265
(3R)-3-methyl-N-[(2R)-4-phenylbutan-2-yl]-N'-(4-propan-2-ylphenyl)pentanediamide
CID 7324001
3-[benzyl(propan-2-yl)amino]-N-[4-(trifluoromethyl)phenyl]propanamide
CID 109031832
N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]-2-phenylacetamide
CID 26686373
2-[methylsulfonyl(2-phenylethyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 21373045
2-[2-[[2-[[2-[[2-[[4-(4-methylanilino)-4-oxobutanoyl]amino]-4-phenylbutanoyl]amino]-3-[4-(trifluoromethyl)phenyl]propanoyl]amino]-3-phenylpropanoyl]amino]propanoylamino]-3-phenylpropanoic acid
CID 90725297
3-methyl-N-(4-phenoxyphenyl)-N'-[3-(trifluoromethyl)phenyl]pentanediamide
CID 3688327
3-(benzylamino)-N-[4-(trifluoromethyl)phenyl]propanamide
CID 42695490
N-(4-bromophenyl)-3-fluoro-5-phenylpentanamide
CID 164670401
3-methyl-N-phenyl-5-phenylmethoxypentanamide
CID 175774392
2-methyl-4-phenyl-N-[3-(trifluoromethyl)phenyl]butanamide
CID 91572023

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide?
The IUPAC name of 3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide (CID 175774255) is 3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide.
What is the SMILES notation for 3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide?
The canonical SMILES for 3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide is CC(CCc1ccccc1)CC(=O)Nc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide?
The InChIKey is ZNLAYLDINIKIEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F3NO/c1-14(7-8-15-5-3-2-4-6-15)13-18(24)23-17-11-9-16(10-12-17)19(20,21)22/h2-6,9-12,14H,7-8,13H2,1H3,(H,23,24).
What are the key properties of 3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide?
3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide has a molecular weight of 335.37 g/mol, XLogP of 5.30, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-phenyl-N-[4-(trifluoromethyl)phenyl]pentanamide is sourced from PubChem (CID 175774255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).