N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide

C18H17Cl2NO3 — CID 54785933

IUPACN-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide
SMILESO=C(Nc1c(Cl)cccc1Cl)c1ccc(OCC2CCCO2)cc1
InChIInChI=1S/C18H17Cl2NO3/c19-15-4-1-5-16(20)17(15)21-18(22)12-6-8-13(9-7-12)24-11-14-3-2-10-23-14/h1,4-9,14H,2-3,10-11H2,(H,21,22)
InChIKeyHAXIADZPSJCZAQ-UHFFFAOYSA-N
MW366.24 g/mol
LogP4.80
Rot. Bonds5

About N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide

N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide (PubChem CID 54785933) has the molecular formula C18H17Cl2NO3 and a molecular weight of 366.24 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide
PubChem CID54785933
Molecular FormulaC18H17Cl2NO3
Molecular Weight366.24 g/mol
Exact Mass365.06
IUPAC NameN-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide
SMILESO=C(Nc1c(Cl)cccc1Cl)c1ccc(OCC2CCCO2)cc1
InChIInChI=1S/C18H17Cl2NO3/c19-15-4-1-5-16(20)17(15)21-18(22)12-6-8-13(9-7-12)24-11-14-3-2-10-23-14/h1,4-9,14H,2-3,10-11H2,(H,21,22)
InChIKeyHAXIADZPSJCZAQ-UHFFFAOYSA-N
XLogP4.80
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.24
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide 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-[3-chloro-2-(dimethylamino)phenyl]-4-(oxolan-2-ylmethoxy)benzamide
CID 55700831
N-(2-chloro-4,6-dimethylphenyl)-4-(oxolan-2-ylmethoxy)benzamide
CID 42908077
4-(oxolan-2-ylmethoxy)-N-(2,4,5-trichlorophenyl)benzamide
CID 17222277
2-chloro-N'-[4-(oxolan-2-ylmethoxy)benzoyl]benzohydrazide
CID 17222475
N-(4-amino-3,5-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide
CID 51193239
3-chloro-N'-[4-[[(2S)-oxolan-2-yl]methoxy]benzoyl]benzohydrazide
CID 2108807
N-naphthalen-1-yl-4-[[(2S)-oxolan-2-yl]methoxy]benzamide
CID 42580238
N'-benzoyl-4-[[(2R)-oxolan-2-yl]methoxy]benzohydrazide
CID 2093036
N-(4-acetamidophenyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 40642293
N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]-4-phenylbenzamide
CID 9294955
4-tert-butyl-N-[3-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]phenyl]benzamide
CID 17232441
4-methyl-N-[4-(oxolan-2-ylmethoxy)phenyl]benzamide
CID 4957909

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide?
The IUPAC name of N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide (CID 54785933) is N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide is O=C(Nc1c(Cl)cccc1Cl)c1ccc(OCC2CCCO2)cc1.
What is the InChIKey of N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide?
The InChIKey is HAXIADZPSJCZAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17Cl2NO3/c19-15-4-1-5-16(20)17(15)21-18(22)12-6-8-13(9-7-12)24-11-14-3-2-10-23-14/h1,4-9,14H,2-3,10-11H2,(H,21,22).
What are the key properties of N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide?
N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide has a molecular weight of 366.24 g/mol, XLogP of 4.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-4-(oxolan-2-ylmethoxy)benzamide is sourced from PubChem (CID 54785933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).