3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide

C23H21ClN2O4 — CID 134132299

IUPAC3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide
SMILESO=C(NCCO)c1ccc(OCc2ccc(Cl)cc2)c(NC(=O)c2ccccc2)c1
InChIInChI=1S/C23H21ClN2O4/c24-19-9-6-16(7-10-19)15-30-21-11-8-18(22(28)25-12-13-27)14-20(21)26-23(29)17-4-2-1-3-5-17/h1-11,14,27H,12-13,15H2,(H,25,28)(H,26,29)
InChIKeyOYXLPQSMLSODGS-UHFFFAOYSA-N
MW424.88 g/mol
LogP3.89
Rot. Bonds8

About 3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide

3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide (PubChem CID 134132299) has the molecular formula C23H21ClN2O4 and a molecular weight of 424.88 g/mol. Its IUPAC name is 3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide
PubChem CID134132299
Molecular FormulaC23H21ClN2O4
Molecular Weight424.88 g/mol
Exact Mass424.12
IUPAC Name3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide
SMILESO=C(NCCO)c1ccc(OCc2ccc(Cl)cc2)c(NC(=O)c2ccccc2)c1
InChIInChI=1S/C23H21ClN2O4/c24-19-9-6-16(7-10-19)15-30-21-11-8-18(22(28)25-12-13-27)14-20(21)26-23(29)17-4-2-1-3-5-17/h1-11,14,27H,12-13,15H2,(H,25,28)(H,26,29)
InChIKeyOYXLPQSMLSODGS-UHFFFAOYSA-N
XLogP3.89
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.88
LogP ≤ 53.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-benzamido-4-[(4-chlorophenyl)methoxy]-N-methylsulfonylbenzamide
CID 134136186
2-benzamido-3-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide
CID 134138644
N-(2-hydroxyethyl)-4-phenylmethoxybenzamide
CID 10825986
3-[(5-methoxycarbonyl-2-phenylmethoxyphenyl)carbamoyl]benzoic acid
CID 167899955
N'-benzoyl-4-[(4-chlorophenoxy)methyl]benzohydrazide
CID 4880251
4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide
CID 119509071
N-(2-hydroxyethyl)-3,5-bis(phenylmethoxy)benzamide
CID 171338561
3-chloro-N-[(5-chloro-2-phenylmethoxyphenyl)methyl]benzamide
CID 23019932
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-pyridin-2-ylbenzamide
CID 43016736
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-(2-oxopropyl)benzamide
CID 158622602
4-[(4-chlorophenyl)methoxy]-3-methoxy-N'-phenylbenzohydrazide
CID 78774841
3-[1-(5-acetyl-2-phenylmethoxyphenyl)propyl]-N-(2-hydroxyethyl)benzamide
CID 67659697

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide?
The IUPAC name of 3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide (CID 134132299) is 3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for 3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide is O=C(NCCO)c1ccc(OCc2ccc(Cl)cc2)c(NC(=O)c2ccccc2)c1.
What is the InChIKey of 3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide?
The InChIKey is OYXLPQSMLSODGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21ClN2O4/c24-19-9-6-16(7-10-19)15-30-21-11-8-18(22(28)25-12-13-27)14-20(21)26-23(29)17-4-2-1-3-5-17/h1-11,14,27H,12-13,15H2,(H,25,28)(H,26,29).
What are the key properties of 3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide?
3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide has a molecular weight of 424.88 g/mol, XLogP of 3.89, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzamido-4-[(4-chlorophenyl)methoxy]-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 134132299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).