N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide

C18H18F3NO2 — CID 24757338

IUPACN-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide
SMILESO=C(Cc1ccc(CCCCc2cc(F)c(F)cc2F)cc1)NO
InChIInChI=1S/C18H18F3NO2/c19-15-11-17(21)16(20)10-14(15)4-2-1-3-12-5-7-13(8-6-12)9-18(23)22-24/h5-8,10-11,24H,1-4,9H2,(H,22,23)
InChIKeyKIXCQRJNCSXILM-UHFFFAOYSA-N
MW337.34 g/mol
LogP3.72
Rot. Bonds7

About N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide

N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide (PubChem CID 24757338) has the molecular formula C18H18F3NO2 and a molecular weight of 337.34 g/mol. Its IUPAC name is N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide
PubChem CID24757338
Molecular FormulaC18H18F3NO2
Molecular Weight337.34 g/mol
Exact Mass337.13
IUPAC NameN-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide
SMILESO=C(Cc1ccc(CCCCc2cc(F)c(F)cc2F)cc1)NO
InChIInChI=1S/C18H18F3NO2/c19-15-11-17(21)16(20)10-14(15)4-2-1-3-12-5-7-13(8-6-12)9-18(23)22-24/h5-8,10-11,24H,1-4,9H2,(H,22,23)
InChIKeyKIXCQRJNCSXILM-UHFFFAOYSA-N
XLogP3.72
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[4-[4-(3,4-dimethylphenyl)butyl]phenyl]-N-hydroxyacetamide
CID 90049516
N-hydroxy-2-[4-[4-[4-[(2-hydroxyacetyl)amino]phenyl]butyl]phenyl]acetamide
CID 73425834
methyl N-[4-[4-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]butyl]phenyl]carbamate
CID 73426367
2-(4-fluorophenyl)-N-[4-(4-fluorophenyl)butyl]acetamide
CID 110288734
N-[[4-[4-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]butyl]phenyl]methyl]piperidine-4-carboxamide;hydrochloride
CID 90046481
N-hydroxy-2-[4-(4-hydroxy-4-pyridin-4-ylbutyl)phenyl]acetamide
CID 59745040
5-(3,4-difluorophenyl)pentanehydrazide
CID 116843725
4-(4-bromophenyl)-N-hydroxybutanamide
CID 139305557
trihydroxy-[5-(2,4,5-trifluorophenyl)pentyl]silane
CID 90174504
N-[4-[4-[4-[2-(hydroxyamino)-2-oxoethyl]phenyl]butyl]phenyl]-N-methylpiperidine-4-carboxamide
CID 90046480
N-hydroxy-2-[4-[(4Z)-4-hydroxyimino-4-phenylbutyl]phenyl]acetamide
CID 90006215
N-hydroxy-2-[4-(4-imino-4-phenylbutyl)phenyl]acetamide
CID 90053412

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide?
The IUPAC name of N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide (CID 24757338) is N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide.
What is the SMILES notation for N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide?
The canonical SMILES for N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide is O=C(Cc1ccc(CCCCc2cc(F)c(F)cc2F)cc1)NO.
What is the InChIKey of N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide?
The InChIKey is KIXCQRJNCSXILM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F3NO2/c19-15-11-17(21)16(20)10-14(15)4-2-1-3-12-5-7-13(8-6-12)9-18(23)22-24/h5-8,10-11,24H,1-4,9H2,(H,22,23).
What are the key properties of N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide?
N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide has a molecular weight of 337.34 g/mol, XLogP of 3.72, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[4-[4-(2,4,5-trifluorophenyl)butyl]phenyl]acetamide is sourced from PubChem (CID 24757338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).