3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide

C14H11Cl2NO3 — CID 86084993

IUPAC3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide
SMILESCOc1cc(Cl)ccc1Oc1ccc(C(N)=O)cc1Cl
InChIInChI=1S/C14H11Cl2NO3/c1-19-13-7-9(15)3-5-12(13)20-11-4-2-8(14(17)18)6-10(11)16/h2-7H,1H3,(H2,17,18)
InChIKeyMGMNEGPBUCTXTJ-UHFFFAOYSA-N
MW312.15 g/mol
LogP3.89
Rot. Bonds4

About 3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide

3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide (PubChem CID 86084993) has the molecular formula C14H11Cl2NO3 and a molecular weight of 312.15 g/mol. Its IUPAC name is 3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide.

Molecular Properties

Compound Name3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide
PubChem CID86084993
Molecular FormulaC14H11Cl2NO3
Molecular Weight312.15 g/mol
Exact Mass311.01
IUPAC Name3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide
SMILESCOc1cc(Cl)ccc1Oc1ccc(C(N)=O)cc1Cl
InChIInChI=1S/C14H11Cl2NO3/c1-19-13-7-9(15)3-5-12(13)20-11-4-2-8(14(17)18)6-10(11)16/h2-7H,1H3,(H2,17,18)
InChIKeyMGMNEGPBUCTXTJ-UHFFFAOYSA-N
XLogP3.89
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.15
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-4-(2,4-dichlorophenoxy)benzamide
CID 43448525
1-[3-chloro-4-(2,4-dichlorophenoxy)phenyl]ethanone
CID 63532509
1-[3-chloro-4-(2,5-dichlorophenoxy)phenyl]ethanone
CID 63533407
(4-chloro-2-methoxyphenyl) carbamate
CID 130017787
3-chloro-4-(2,5-dichlorophenoxy)benzoic acid
CID 63513310
4-chloro-2-[4-(hydroxymethyl)-2-methoxyphenoxy]benzamide
CID 107743804
(3-chloro-4-methoxyphenyl)-(5-chloro-2-methoxyphenyl)methanone
CID 43161713
1-[3-chloro-4-(4-chloro-2-methylphenoxy)phenyl]ethanone
CID 55222650
4-chloro-2-methoxybenzamide
CID 19741766
3-amino-4-(4-chloro-2-methylphenoxy)benzamide
CID 43448530
4-amino-3-(4-chloro-2-methylphenoxy)benzamide
CID 55188748
4-(4-amino-2,6-difluorophenoxy)-3-methoxybenzamide
CID 61015827

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide?
The IUPAC name of 3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide (CID 86084993) is 3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide.
What is the SMILES notation for 3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide?
The canonical SMILES for 3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide is COc1cc(Cl)ccc1Oc1ccc(C(N)=O)cc1Cl.
What is the InChIKey of 3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide?
The InChIKey is MGMNEGPBUCTXTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2NO3/c1-19-13-7-9(15)3-5-12(13)20-11-4-2-8(14(17)18)6-10(11)16/h2-7H,1H3,(H2,17,18).
What are the key properties of 3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide?
3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide has a molecular weight of 312.15 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-(4-chloro-2-methoxyphenoxy)benzamide is sourced from PubChem (CID 86084993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).