N-(3-chlorophenyl)-3-(dimethylamino)benzamide

C15H15ClN2O — CID 690525

IUPACN-(3-chlorophenyl)-3-(dimethylamino)benzamide
SMILESCN(C)c1cccc(C(=O)Nc2cccc(Cl)c2)c1
InChIInChI=1S/C15H15ClN2O/c1-18(2)14-8-3-5-11(9-14)15(19)17-13-7-4-6-12(16)10-13/h3-10H,1-2H3,(H,17,19)
InChIKeyCVTHNNWZRJCXFN-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.66
Rot. Bonds3

About N-(3-chlorophenyl)-3-(dimethylamino)benzamide

N-(3-chlorophenyl)-3-(dimethylamino)benzamide (PubChem CID 690525) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-(dimethylamino)benzamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-(dimethylamino)benzamide
PubChem CID690525
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC NameN-(3-chlorophenyl)-3-(dimethylamino)benzamide
SMILESCN(C)c1cccc(C(=O)Nc2cccc(Cl)c2)c1
InChIInChI=1S/C15H15ClN2O/c1-18(2)14-8-3-5-11(9-14)15(19)17-13-7-4-6-12(16)10-13/h3-10H,1-2H3,(H,17,19)
InChIKeyCVTHNNWZRJCXFN-UHFFFAOYSA-N
XLogP3.66
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-(dimethylamino)benzamide?
The IUPAC name of N-(3-chlorophenyl)-3-(dimethylamino)benzamide (CID 690525) is N-(3-chlorophenyl)-3-(dimethylamino)benzamide.
What is the SMILES notation for N-(3-chlorophenyl)-3-(dimethylamino)benzamide?
The canonical SMILES for N-(3-chlorophenyl)-3-(dimethylamino)benzamide is CN(C)c1cccc(C(=O)Nc2cccc(Cl)c2)c1.
What is the InChIKey of N-(3-chlorophenyl)-3-(dimethylamino)benzamide?
The InChIKey is CVTHNNWZRJCXFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O/c1-18(2)14-8-3-5-11(9-14)15(19)17-13-7-4-6-12(16)10-13/h3-10H,1-2H3,(H,17,19).
What are the key properties of N-(3-chlorophenyl)-3-(dimethylamino)benzamide?
N-(3-chlorophenyl)-3-(dimethylamino)benzamide has a molecular weight of 274.75 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-3-(dimethylamino)benzamide is sourced from PubChem (CID 690525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).