3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide

C14H10Cl3NO2 — CID 91683401

IUPAC3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide
SMILESNC(=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)c(Cl)c1
InChIInChI=1S/C14H10Cl3NO2/c15-10-3-1-8(5-11(10)16)7-20-13-4-2-9(14(18)19)6-12(13)17/h1-6H,7H2,(H2,18,19)
InChIKeySNNUDLIPUXOFNH-UHFFFAOYSA-N
MW330.60 g/mol
LogP4.32
Rot. Bonds4

About 3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide

3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide (PubChem CID 91683401) has the molecular formula C14H10Cl3NO2 and a molecular weight of 330.60 g/mol. Its IUPAC name is 3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide.

Molecular Properties

Compound Name3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide
PubChem CID91683401
Molecular FormulaC14H10Cl3NO2
Molecular Weight330.60 g/mol
Exact Mass328.98
IUPAC Name3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide
SMILESNC(=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)c(Cl)c1
InChIInChI=1S/C14H10Cl3NO2/c15-10-3-1-8(5-11(10)16)7-20-13-4-2-9(14(18)19)6-12(13)17/h1-6H,7H2,(H2,18,19)
InChIKeySNNUDLIPUXOFNH-UHFFFAOYSA-N
XLogP4.32
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.60
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(3,4-dichlorophenyl)methoxy]-3-methoxybenzamide
CID 6458100
3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzohydrazide
CID 91683384
3-chloro-4-[(4-fluorophenyl)methoxy]benzamide
CID 91681954
4-[(4-carbamoylphenyl)methoxy]-3-chlorobenzoic acid
CID 60711874
4-[(3-bromophenyl)methoxy]-3-chlorobenzamide
CID 91683338
4-[(2-chloro-4-fluorophenoxy)methyl]benzamide
CID 27313029
3-bromo-4-[(3,4-dichlorophenyl)methoxy]benzohydrazide
CID 91683383
3-[(3,4-dichlorophenyl)methoxy]-4-methylbenzoic acid
CID 45311939
4-[(3,4-dichlorophenyl)methoxy]-3-ethoxybenzenecarbothioamide
CID 20988291
methyl 4-amino-3-[(3,4-dichlorophenyl)methoxy]benzoate
CID 43380152
N-carbamothioyl-4-[(3,4-dichlorophenyl)methoxy]-3-methoxybenzamide
CID 132591182
1-[3-chloro-4-[(4-chlorophenyl)methoxy]phenyl]ethanone
CID 65125936

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide?
The IUPAC name of 3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide (CID 91683401) is 3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide.
What is the SMILES notation for 3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide?
The canonical SMILES for 3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide is NC(=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)c(Cl)c1.
What is the InChIKey of 3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide?
The InChIKey is SNNUDLIPUXOFNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3NO2/c15-10-3-1-8(5-11(10)16)7-20-13-4-2-9(14(18)19)6-12(13)17/h1-6H,7H2,(H2,18,19).
What are the key properties of 3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide?
3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide has a molecular weight of 330.60 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide is sourced from PubChem (CID 91683401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).