4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide

C15H14ClNO3 — CID 107709587

IUPAC4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide
SMILESNC(=O)c1ccc(Cl)cc1Oc1ccc(CCO)cc1
InChIInChI=1S/C15H14ClNO3/c16-11-3-6-13(15(17)19)14(9-11)20-12-4-1-10(2-5-12)7-8-18/h1-6,9,18H,7-8H2,(H2,17,19)
InChIKeyHRBGXMWCSSTGPA-UHFFFAOYSA-N
MW291.73 g/mol
LogP2.77
Rot. Bonds5

About 4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide

4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide (PubChem CID 107709587) has the molecular formula C15H14ClNO3 and a molecular weight of 291.73 g/mol. Its IUPAC name is 4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide.

Molecular Properties

Compound Name4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide
PubChem CID107709587
Molecular FormulaC15H14ClNO3
Molecular Weight291.73 g/mol
Exact Mass291.07
IUPAC Name4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide
SMILESNC(=O)c1ccc(Cl)cc1Oc1ccc(CCO)cc1
InChIInChI=1S/C15H14ClNO3/c16-11-3-6-13(15(17)19)14(9-11)20-12-4-1-10(2-5-12)7-8-18/h1-6,9,18H,7-8H2,(H2,17,19)
InChIKeyHRBGXMWCSSTGPA-UHFFFAOYSA-N
XLogP2.77
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.73
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(2-hydroxyethyl)phenoxy]benzamide
CID 107709685
2-[4-[2-(aminomethyl)-5-chlorophenoxy]phenyl]ethanol
CID 107708372
2-bromo-4-[4-(2-hydroxyethyl)phenoxy]benzamide
CID 107709609
3-fluoro-4-[4-(2-hydroxyethyl)phenoxy]benzamide
CID 107709668
4-chloro-2-[4-(hydroxymethyl)-2-methoxyphenoxy]benzamide
CID 107743804
4-chloro-2-ethoxybenzamide
CID 126998915
4-chloro-2-(4-propylphenoxy)benzenecarboximidamide
CID 63524864
2-[4-(2-hydroxyethyl)phenoxy]-4-methylbenzoic acid
CID 107708690
5-chloro-2-(4-propylphenoxy)benzenecarbothioamide
CID 63518437
4-chloro-2-methoxybenzamide
CID 19741766
2-[4-(aminomethyl)phenoxy]-4-methylbenzamide
CID 106485646
4-chloro-2-(4-methylphenoxy)benzenecarbothioamide
CID 63092156

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide?
The IUPAC name of 4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide (CID 107709587) is 4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide.
What is the SMILES notation for 4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide?
The canonical SMILES for 4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide is NC(=O)c1ccc(Cl)cc1Oc1ccc(CCO)cc1.
What is the InChIKey of 4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide?
The InChIKey is HRBGXMWCSSTGPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO3/c16-11-3-6-13(15(17)19)14(9-11)20-12-4-1-10(2-5-12)7-8-18/h1-6,9,18H,7-8H2,(H2,17,19).
What are the key properties of 4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide?
4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide has a molecular weight of 291.73 g/mol, XLogP of 2.77, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[4-(2-hydroxyethyl)phenoxy]benzamide is sourced from PubChem (CID 107709587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).