2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide

C16H15Cl2NO2 — CID 17154669

IUPAC2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide
SMILESCC(C)Oc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C16H15Cl2NO2/c1-10(2)21-13-5-3-4-12(9-13)19-16(20)14-7-6-11(17)8-15(14)18/h3-10H,1-2H3,(H,19,20)
InChIKeyFGQOFQYYRZQMQX-UHFFFAOYSA-N
MW324.21 g/mol
LogP5.03
Rot. Bonds4

About 2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide

2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide (PubChem CID 17154669) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is 2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide
PubChem CID17154669
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC Name2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide
SMILESCC(C)Oc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C16H15Cl2NO2/c1-10(2)21-13-5-3-4-12(9-13)19-16(20)14-7-6-11(17)8-15(14)18/h3-10H,1-2H3,(H,19,20)
InChIKeyFGQOFQYYRZQMQX-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

2,4-dichloro-N-[3-(2-methylpropoxy)phenyl]benzamide
CID 17079524
5-chloro-2-hydroxy-N-(3-propan-2-yloxyphenyl)benzamide
CID 70853824
2,4-dichloro-N-[3-[(2-methylbenzoyl)amino]phenyl]benzamide
CID 1048560
3-[(2,4-dichlorobenzoyl)amino]benzoyl chloride
CID 87323399
2,4-dichloro-N-[1-(3-methoxyanilino)-4-methyl-1-oxopentan-2-yl]benzamide
CID 43001585
2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide
CID 886020
2,4-dichloro-N'-(4-propan-2-yloxybenzoyl)benzohydrazide
CID 4952081
N-(4-butan-2-yloxyphenyl)-2,4-dichlorobenzamide
CID 17160527
N-(3-chlorophenyl)-4-propan-2-yloxybenzamide
CID 823397
2,4-dichloro-N-[3-[(2,2-diphenylacetyl)amino]phenyl]benzamide
CID 3385314
ethyl 3-[(2,4-dichlorobenzoyl)amino]benzoate
CID 769408
2,4-dichloro-N-[3-[1-oxo-1-(4-phenoxyanilino)propan-2-yl]sulfanylphenyl]benzamide
CID 18902134

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide?
The IUPAC name of 2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide (CID 17154669) is 2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide.
What is the SMILES notation for 2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide?
The canonical SMILES for 2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide is CC(C)Oc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide?
The InChIKey is FGQOFQYYRZQMQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-10(2)21-13-5-3-4-12(9-13)19-16(20)14-7-6-11(17)8-15(14)18/h3-10H,1-2H3,(H,19,20).
What are the key properties of 2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide?
2,4-dichloro-N-(3-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 2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide is sourced from PubChem (CID 17154669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).