N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide

C15H11ClF3NO2 — CID 141336547

IUPACN-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide
SMILESO=C(Nc1cccc(Cl)c1)C(O)(c1ccccc1)C(F)(F)F
InChIInChI=1S/C15H11ClF3NO2/c16-11-7-4-8-12(9-11)20-13(21)14(22,15(17,18)19)10-5-2-1-3-6-10/h1-9,22H,(H,20,21)
InChIKeyVKVOINRVQKKOSU-UHFFFAOYSA-N
MW329.71 g/mol
LogP3.73
Rot. Bonds3

About N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide

N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide (PubChem CID 141336547) has the molecular formula C15H11ClF3NO2 and a molecular weight of 329.71 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide
PubChem CID141336547
Molecular FormulaC15H11ClF3NO2
Molecular Weight329.71 g/mol
Exact Mass329.04
IUPAC NameN-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide
SMILESO=C(Nc1cccc(Cl)c1)C(O)(c1ccccc1)C(F)(F)F
InChIInChI=1S/C15H11ClF3NO2/c16-11-7-4-8-12(9-11)20-13(21)14(22,15(17,18)19)10-5-2-1-3-6-10/h1-9,22H,(H,20,21)
InChIKeyVKVOINRVQKKOSU-UHFFFAOYSA-N
XLogP3.73
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.71
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chlorophenyl)-2,2-bis(trifluoromethyl)butanamide
CID 3326093
chlorobenzene;[3-(trifluoromethyl)phenyl]carbamic acid
CID 174624155
N-(3-chlorophenyl)-2,2-difluoro-3-iodopropanamide
CID 14154828
N-(3-chlorophenyl)acetamide;N-phenylacetamide
CID 160915382
(Z)-3-(3-chloroanilino)-N-(3-chlorophenyl)-4,4,4-trifluorobut-2-enamide
CID 110272456
methyl 2-[4-[(3-chlorophenyl)carbamoylamino]-3-methylphenyl]-3,3,3-trifluoro-2-hydroxypropanoate
CID 2817861
2-amino-N-(3-chlorophenyl)-2-ethylbutanamide
CID 79809226
methyl N-(3-chlorophenyl)carbamate
CID 16529
(2R)-3,3,3-trifluoro-2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 10542294
N-(3-chlorophenyl)-3-[3-(trifluoromethyl)anilino]propanamide
CID 109037972
N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide
CID 3264601
N-(3-chlorophenyl)-2-[(2,2,2-trifluoro-1-phenylethyl)amino]acetamide
CID 86861058

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide?
The IUPAC name of N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide (CID 141336547) is N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide.
What is the SMILES notation for N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide?
The canonical SMILES for N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide is O=C(Nc1cccc(Cl)c1)C(O)(c1ccccc1)C(F)(F)F.
What is the InChIKey of N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide?
The InChIKey is VKVOINRVQKKOSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClF3NO2/c16-11-7-4-8-12(9-11)20-13(21)14(22,15(17,18)19)10-5-2-1-3-6-10/h1-9,22H,(H,20,21).
What are the key properties of N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide?
N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide has a molecular weight of 329.71 g/mol, XLogP of 3.73, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide is sourced from PubChem (CID 141336547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).