N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide

C14H18F2N2O3 — CID 58624316

IUPACN-(3,4-difluorophenyl)-N'-hydroxyoctanediamide
SMILESO=C(CCCCCCC(=O)Nc1ccc(F)c(F)c1)NO
InChIInChI=1S/C14H18F2N2O3/c15-11-8-7-10(9-12(11)16)17-13(19)5-3-1-2-4-6-14(20)18-21/h7-9,21H,1-6H2,(H,17,19)(H,18,20)
InChIKeyCVXJGCCMAOCXJA-UHFFFAOYSA-N
MW300.30 g/mol
LogP2.75
Rot. Bonds8

About N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide

N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide (PubChem CID 58624316) has the molecular formula C14H18F2N2O3 and a molecular weight of 300.30 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-N'-hydroxyoctanediamide
PubChem CID58624316
Molecular FormulaC14H18F2N2O3
Molecular Weight300.30 g/mol
Exact Mass300.13
IUPAC NameN-(3,4-difluorophenyl)-N'-hydroxyoctanediamide
SMILESO=C(CCCCCCC(=O)Nc1ccc(F)c(F)c1)NO
InChIInChI=1S/C14H18F2N2O3/c15-11-8-7-10(9-12(11)16)17-13(19)5-3-1-2-4-6-14(20)18-21/h7-9,21H,1-6H2,(H,17,19)(H,18,20)
InChIKeyCVXJGCCMAOCXJA-UHFFFAOYSA-N
XLogP2.75
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.30
LogP ≤ 52.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N'-bis(3,4-difluorophenyl)butanediamide
CID 896186
5-chloro-N-(3,4-difluorophenyl)pentanamide
CID 28971468
N-(3,4-difluorophenyl)-4-(methylamino)butanamide
CID 60843097
N,N'-bis(3,4-difluorophenyl)propanediamide
CID 108956967
4-[[8-(hydroxyamino)-8-oxooctanoyl]amino]phthalic acid
CID 50916877
5-amino-N-(3,4-difluorophenyl)hexanamide
CID 82848790
N-(4-bromo-3-fluorophenyl)octanamide
CID 65429012
N-(3,4-difluorophenyl)propanamide
CID 4285365
2-amino-N-(3,4-difluorophenyl)acetamide
CID 2410802
N-(3-fluoro-4-hydroxyphenyl)decanamide
CID 65426538
6-amino-N-(3-fluoro-4-methylphenyl)hexanamide
CID 24704997
N-(4-bromo-3-fluorophenyl)-5-chloropentanamide
CID 65436710

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide?
The IUPAC name of N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide (CID 58624316) is N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide?
The canonical SMILES for N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide is O=C(CCCCCCC(=O)Nc1ccc(F)c(F)c1)NO.
What is the InChIKey of N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide?
The InChIKey is CVXJGCCMAOCXJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O3/c15-11-8-7-10(9-12(11)16)17-13(19)5-3-1-2-4-6-14(20)18-21/h7-9,21H,1-6H2,(H,17,19)(H,18,20).
What are the key properties of N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide?
N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide has a molecular weight of 300.30 g/mol, XLogP of 2.75, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-N'-hydroxyoctanediamide is sourced from PubChem (CID 58624316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).