N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide

C16H15ClF2N2O2 — CID 24576004

IUPACN-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)cc1
InChIInChI=1S/C16H15ClF2N2O2/c1-21(2)12-6-3-10(4-7-12)15(22)20-11-5-8-14(13(17)9-11)23-16(18)19/h3-9,16H,1-2H3,(H,20,22)
InChIKeyRLIHTXJODNNKHH-UHFFFAOYSA-N
MW340.76 g/mol
LogP4.26
Rot. Bonds5

About N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide

N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide (PubChem CID 24576004) has the molecular formula C16H15ClF2N2O2 and a molecular weight of 340.76 g/mol. Its IUPAC name is N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide.

Molecular Properties

Compound NameN-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide
PubChem CID24576004
Molecular FormulaC16H15ClF2N2O2
Molecular Weight340.76 g/mol
Exact Mass340.08
IUPAC NameN-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)cc1
InChIInChI=1S/C16H15ClF2N2O2/c1-21(2)12-6-3-10(4-7-12)15(22)20-11-5-8-14(13(17)9-11)23-16(18)19/h3-9,16H,1-2H3,(H,20,22)
InChIKeyRLIHTXJODNNKHH-UHFFFAOYSA-N
XLogP4.26
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.76
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)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

3-(carbamoylamino)-N-[3-chloro-4-(difluoromethoxy)phenyl]benzamide
CID 26247982
N-[3-chloro-4-(difluoromethoxy)phenyl]-2,2-difluoroacetamide
CID 113218222
4-amino-N-(3-chloro-4-propan-2-yloxyphenyl)benzamide
CID 43712010
N-[3-chloro-4-(difluoromethoxy)phenyl]-2,5-dimethylthiophene-3-carboxamide
CID 37040206
N-[3-chloro-4-(difluoromethoxy)phenyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 26901420
N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide
CID 2579010
2-chloro-N-[3-chloro-4-(difluoromethoxy)phenyl]acetamide
CID 4885557
N-(3-chloro-4-methoxyphenyl)-4-[dimethylsulfamoyl(methyl)amino]benzamide
CID 92664148
ethyl N-[3-chloro-4-(difluoromethoxy)phenyl]carbamate
CID 60637785
1-[3-chloro-4-(difluoromethoxy)phenyl]-3-(3,4-dimethoxyphenyl)urea
CID 1297847
N-[3-chloro-4-(difluoromethoxy)phenyl]-3-(4-methylphenyl)-1H-pyrazole-5-carboxamide
CID 19510356
N-[4-(difluoromethoxy)-3-methoxyphenyl]-4-methylbenzamide
CID 4865288

Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide?
The IUPAC name of N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide (CID 24576004) is N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide.
What is the SMILES notation for N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide?
The canonical SMILES for N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide is CN(C)c1ccc(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)cc1.
What is the InChIKey of N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide?
The InChIKey is RLIHTXJODNNKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClF2N2O2/c1-21(2)12-6-3-10(4-7-12)15(22)20-11-5-8-14(13(17)9-11)23-16(18)19/h3-9,16H,1-2H3,(H,20,22).
What are the key properties of N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide?
N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide has a molecular weight of 340.76 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide is sourced from PubChem (CID 24576004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).