N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide

C15H14ClNO4 — CID 772092

IUPACN-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide
SMILESCOc1cc(OC)c(NC(=O)c2ccccc2O)cc1Cl
InChIInChI=1S/C15H14ClNO4/c1-20-13-8-14(21-2)11(7-10(13)16)17-15(19)9-5-3-4-6-12(9)18/h3-8,18H,1-2H3,(H,17,19)
InChIKeyBSCKAWLHRXNJFK-UHFFFAOYSA-N
MW307.73 g/mol
LogP3.32
Rot. Bonds4

About N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide

N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide (PubChem CID 772092) has the molecular formula C15H14ClNO4 and a molecular weight of 307.73 g/mol. Its IUPAC name is N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide
PubChem CID772092
Molecular FormulaC15H14ClNO4
Molecular Weight307.73 g/mol
Exact Mass307.06
IUPAC NameN-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide
SMILESCOc1cc(OC)c(NC(=O)c2ccccc2O)cc1Cl
InChIInChI=1S/C15H14ClNO4/c1-20-13-8-14(21-2)11(7-10(13)16)17-15(19)9-5-3-4-6-12(9)18/h3-8,18H,1-2H3,(H,17,19)
InChIKeyBSCKAWLHRXNJFK-UHFFFAOYSA-N
XLogP3.32
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.73
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide?
The IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide (CID 772092) is N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide.
What is the SMILES notation for N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide?
The canonical SMILES for N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide is COc1cc(OC)c(NC(=O)c2ccccc2O)cc1Cl.
What is the InChIKey of N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide?
The InChIKey is BSCKAWLHRXNJFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO4/c1-20-13-8-14(21-2)11(7-10(13)16)17-15(19)9-5-3-4-6-12(9)18/h3-8,18H,1-2H3,(H,17,19).
What are the key properties of N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide?
N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide has a molecular weight of 307.73 g/mol, XLogP of 3.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide is sourced from PubChem (CID 772092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).