3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide

C16H15Cl2NO2 — CID 17151016

IUPAC3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide
SMILESCC(C)Oc1ccccc1NC(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C16H15Cl2NO2/c1-10(2)21-15-6-4-3-5-14(15)19-16(20)11-7-12(17)9-13(18)8-11/h3-10H,1-2H3,(H,19,20)
InChIKeySCLZEZURWFGHTP-UHFFFAOYSA-N
MW324.21 g/mol
LogP5.03
Rot. Bonds4

About 3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide

3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide (PubChem CID 17151016) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is 3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide.

Molecular Properties

Compound Name3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide
PubChem CID17151016
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC Name3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide
SMILESCC(C)Oc1ccccc1NC(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C16H15Cl2NO2/c1-10(2)21-15-6-4-3-5-14(15)19-16(20)11-7-12(17)9-13(18)8-11/h3-10H,1-2H3,(H,19,20)
InChIKeySCLZEZURWFGHTP-UHFFFAOYSA-N
XLogP5.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.21
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4,5-trimethoxy-N-(2-propan-2-yloxyphenyl)benzamide
CID 673819
3,5-dichloro-N-(2-ethoxyphenyl)benzamide
CID 2442507
1-N-phenyl-4-N-(2-propan-2-yloxyphenyl)benzene-1,4-dicarboxamide
CID 109049242
3-methyl-N-(2-propan-2-yloxyphenyl)benzamide
CID 17150877
3-amino-N-(2-propan-2-yloxyphenyl)benzamide
CID 28722379
3-bromo-4-propan-2-yloxy-N-(2-propan-2-yloxyphenyl)benzamide
CID 17150992
N,N'-bis(2-propan-2-yloxyphenyl)oxamide
CID 108987298
5-chloro-N-(2-propan-2-yloxyphenyl)-1,3,4-thiadiazole-2-carboxamide
CID 80625354
1-N-(3-methylphenyl)-4-N-(2-propan-2-yloxyphenyl)benzene-1,4-dicarboxamide
CID 109049370
1-N-(2-methylpropyl)-4-N-(2-propan-2-yloxyphenyl)benzene-1,4-dicarboxamide
CID 109043960
3-bromo-4-methoxy-N-(2-propan-2-yloxyphenyl)benzamide
CID 17150898
3-cyano-N-(2-propan-2-yloxyphenyl)benzamide
CID 38999846

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide?
The IUPAC name of 3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide (CID 17151016) is 3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide.
What is the SMILES notation for 3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide?
The canonical SMILES for 3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide is CC(C)Oc1ccccc1NC(=O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide?
The InChIKey is SCLZEZURWFGHTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-10(2)21-15-6-4-3-5-14(15)19-16(20)11-7-12(17)9-13(18)8-11/h3-10H,1-2H3,(H,19,20).
What are the key properties of 3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide?
3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide has a molecular weight of 324.21 g/mol, XLogP of 5.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide is sourced from PubChem (CID 17151016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).