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Meclofenamic acid

C14H11Cl2NO2 — CID 4037

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Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC2-(2,6-dichloro-3-methylanilino)benzoic acid
SMILESCc1ccc(Cl)c(Nc2ccccc2C(=O)O)c1Cl
InChIInChI=1S/C14H11Cl2NO2/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19/h2-7,17H,1H3,(H,18,19)
InChIKeySBDNJUWAMKYJOX-UHFFFAOYSA-N
MW296.15 g/mol
LogP4.74
Rot. Bonds3

About Meclofenamic acid

Meclofenamic acid (PubChem CID 4037) has the molecular formula C14H11Cl2NO2 and a molecular weight of 296.15 g/mol. Its IUPAC name is 2-(2,6-dichloro-3-methylanilino)benzoic acid.

Molecular Properties

Compound NameMeclofenamic acid
PubChem CID4037
Molecular FormulaC14H11Cl2NO2
Molecular Weight296.15 g/mol
Exact Mass295.02
IUPAC Name2-(2,6-dichloro-3-methylanilino)benzoic acid
SMILESCc1ccc(Cl)c(Nc2ccccc2C(=O)O)c1Cl
InChIInChI=1S/C14H11Cl2NO2/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19/h2-7,17H,1H3,(H,18,19)
InChIKeySBDNJUWAMKYJOX-UHFFFAOYSA-N
XLogP4.74
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.15
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Meclofenamate Sodium
CID 4038
Tolfenamic Acid
CID 610479
N-Phenylanthranilic Acid
CID 4386
Zapnometinib
CID 10112191
2-[(2,6-Dichloro-3-methylphenyl)amino]benzoate
CID 4036
2-(4-Amylcinnamoyl)amino-4-chlorobenzoic acid
CID 6438389
2-(2,4-Dichlorobenzamido)-5-methylbenzoic acid
CID 4287647
2-((4-Chlorobenzyl)amino)benzoic acid
CID 3538522

Frequently Asked Questions

What is the IUPAC name of Meclofenamic acid?
The IUPAC name of Meclofenamic acid (CID 4037) is 2-(2,6-dichloro-3-methylanilino)benzoic acid.
What is the SMILES notation for Meclofenamic acid?
The canonical SMILES for Meclofenamic acid is Cc1ccc(Cl)c(Nc2ccccc2C(=O)O)c1Cl.
What is the InChIKey of Meclofenamic acid?
The InChIKey is SBDNJUWAMKYJOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2NO2/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19/h2-7,17H,1H3,(H,18,19).
What are the key properties of Meclofenamic acid?
Meclofenamic acid has a molecular weight of 296.15 g/mol, XLogP of 4.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Meclofenamic acid is sourced from PubChem (CID 4037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

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