3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide

C15H10Cl2N2O — CID 62981026

IUPAC3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide
SMILESCN(C(=O)c1cc(Cl)cc(Cl)c1)c1ccc(C#N)cc1
InChIInChI=1S/C15H10Cl2N2O/c1-19(14-4-2-10(9-18)3-5-14)15(20)11-6-12(16)8-13(17)7-11/h2-8H,1H3
InChIKeyHLTRXVJNEHNPTE-UHFFFAOYSA-N
MW305.16 g/mol
LogP4.14
Rot. Bonds2

About 3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide

3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide (PubChem CID 62981026) has the molecular formula C15H10Cl2N2O and a molecular weight of 305.16 g/mol. Its IUPAC name is 3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide.

Molecular Properties

Compound Name3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide
PubChem CID62981026
Molecular FormulaC15H10Cl2N2O
Molecular Weight305.16 g/mol
Exact Mass304.02
IUPAC Name3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide
SMILESCN(C(=O)c1cc(Cl)cc(Cl)c1)c1ccc(C#N)cc1
InChIInChI=1S/C15H10Cl2N2O/c1-19(14-4-2-10(9-18)3-5-14)15(20)11-6-12(16)8-13(17)7-11/h2-8H,1H3
InChIKeyHLTRXVJNEHNPTE-UHFFFAOYSA-N
XLogP4.14
TPSA44.10 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.16
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide
CID 62982925
N-(4-cyanophenyl)-3-(dimethylamino)-N-methylbenzamide
CID 62983461
3,5-dichloro-N-methyl-N-phenylbenzamide;ethane
CID 156791859
N-(4-cyanophenyl)-N-methyl-3-sulfanylbenzamide
CID 107028997
4-bromo-N-(4-cyanophenyl)-N,3-dimethylbenzamide
CID 115772398
N-(4-cyanophenyl)-3-methoxy-N-methylbenzamide
CID 62982758
N-(4-cyanophenyl)-3-(3,5-dichlorophenyl)-N,2-dimethyl-7-propan-2-ylpyrazolo[1,5-a]pyridine-5-carboxamide
CID 177097870
N-(4-cyanophenyl)-N-methylpyridazine-4-carboxamide
CID 104670312
3-(4-chlorophenyl)-1-(4-cyanophenyl)-1-methylurea
CID 62983110
6-chloro-N-(4-cyanophenyl)-N-methylpyridine-2-carboxamide
CID 62981263
N-(4-cyanophenyl)-N-methyl-2-(methylamino)pyridine-4-carboxamide
CID 62970236
2,5-dichloro-N-(4-cyanophenyl)-N-methylpyridine-4-carboxamide
CID 114918456

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide?
The IUPAC name of 3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide (CID 62981026) is 3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide.
What is the SMILES notation for 3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide?
The canonical SMILES for 3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide is CN(C(=O)c1cc(Cl)cc(Cl)c1)c1ccc(C#N)cc1.
What is the InChIKey of 3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide?
The InChIKey is HLTRXVJNEHNPTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2N2O/c1-19(14-4-2-10(9-18)3-5-14)15(20)11-6-12(16)8-13(17)7-11/h2-8H,1H3.
What are the key properties of 3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide?
3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide has a molecular weight of 305.16 g/mol, XLogP of 4.14, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide is sourced from PubChem (CID 62981026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).