N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide

C16H15Cl2NO2 — CID 4318037

IUPACN-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide
SMILESCC(C)Oc1cccc(C(=O)Nc2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C16H15Cl2NO2/c1-10(2)21-15-5-3-4-11(6-15)16(20)19-14-8-12(17)7-13(18)9-14/h3-10H,1-2H3,(H,19,20)
InChIKeyYIUAIHZCUVAWAW-UHFFFAOYSA-N
MW324.21 g/mol
LogP5.03
Rot. Bonds4

About N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide

N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide (PubChem CID 4318037) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide
PubChem CID4318037
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC NameN-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide
SMILESCC(C)Oc1cccc(C(=O)Nc2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C16H15Cl2NO2/c1-10(2)21-15-5-3-4-11(6-15)16(20)19-14-8-12(17)7-13(18)9-14/h3-10H,1-2H3,(H,19,20)
InChIKeyYIUAIHZCUVAWAW-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

dimethyl 5-[(3-propan-2-yloxybenzoyl)amino]benzene-1,3-dicarboxylate
CID 1339052
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3-propan-2-yloxy-N-[4-[[4-[(3-propan-2-yloxybenzoyl)amino]phenyl]methyl]phenyl]benzamide
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N-(4-phenoxyphenyl)-3-propan-2-yloxybenzamide
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N-(3-chlorophenyl)-4-propan-2-yloxybenzamide
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N-(3-bromo-4-fluorophenyl)-3-propan-2-yloxybenzamide
CID 104779320
N-propan-2-yl-3-propan-2-yloxybenzamide
CID 8779048
3-[(3,5-dichlorophenyl)carbamoyl]benzoic acid
CID 43452757
N-(3-amino-4-bromophenyl)-3-propan-2-yloxybenzamide
CID 79753661
N-[4-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide
CID 17142469
2,4-dichloro-5-[(3-propan-2-yloxybenzoyl)amino]benzoic acid
CID 28672335
3-propan-2-yloxy-N-(1-propan-2-ylpyrazol-4-yl)benzamide
CID 134702922

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide?
The IUPAC name of N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide (CID 4318037) is N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide is CC(C)Oc1cccc(C(=O)Nc2cc(Cl)cc(Cl)c2)c1.
What is the InChIKey of N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide?
The InChIKey is YIUAIHZCUVAWAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-10(2)21-15-5-3-4-11(6-15)16(20)19-14-8-12(17)7-13(18)9-14/h3-10H,1-2H3,(H,19,20).
What are the key properties of N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide?
N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide 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 N-(3,5-dichlorophenyl)-3-propan-2-yloxybenzamide is sourced from PubChem (CID 4318037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).