4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide

C15H15ClN2O2 — CID 61237813

IUPAC4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide
SMILESNc1ccc(C(=O)NCCc2ccc(O)cc2)c(Cl)c1
InChIInChI=1S/C15H15ClN2O2/c16-14-9-11(17)3-6-13(14)15(20)18-8-7-10-1-4-12(19)5-2-10/h1-6,9,19H,7-8,17H2,(H,18,20)
InChIKeyWHIQYHWRLUMPCZ-UHFFFAOYSA-N
MW290.75 g/mol
LogP2.60
Rot. Bonds4

About 4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide

4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide (PubChem CID 61237813) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide.

Molecular Properties

Compound Name4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide
PubChem CID61237813
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide
SMILESNc1ccc(C(=O)NCCc2ccc(O)cc2)c(Cl)c1
InChIInChI=1S/C15H15ClN2O2/c16-14-9-11(17)3-6-13(14)15(20)18-8-7-10-1-4-12(19)5-2-10/h1-6,9,19H,7-8,17H2,(H,18,20)
InChIKeyWHIQYHWRLUMPCZ-UHFFFAOYSA-N
XLogP2.60
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(4-aminophenyl)ethyl]-2-chloro-5-hydroxybenzamide
CID 106500100
5-amino-2-fluoro-N-[2-(4-hydroxyphenyl)ethyl]benzamide
CID 61238534
N'-(4-amino-2-chlorophenyl)-N-[2-(4-hydroxyphenyl)ethyl]oxamide
CID 108503034
4-amino-2-chloro-N-(3-hydroxypropyl)benzamide
CID 43167675
4-amino-2-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide
CID 63831646
2-amino-N-[2-(4-chlorophenyl)ethyl]-5-hydroxybenzamide
CID 107074342
N-[2-(4-chlorophenyl)ethyl]-2-fluoro-4-hydroxybenzamide
CID 103939851
4-amino-2-chloro-N-ethylbenzamide;hydrochloride
CID 47000809
4-amino-N-(2-amino-2-oxoethyl)-2-chlorobenzamide
CID 16775677
N-[2-(4-aminophenyl)ethyl]-2-hydroxy-4-methoxybenzamide
CID 61220987
4-amino-2-chloro-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]benzamide
CID 80681439
4-amino-2-chloro-N-hex-5-ynylbenzamide
CID 106208110

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide?
The IUPAC name of 4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide (CID 61237813) is 4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide.
What is the SMILES notation for 4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide?
The canonical SMILES for 4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide is Nc1ccc(C(=O)NCCc2ccc(O)cc2)c(Cl)c1.
What is the InChIKey of 4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide?
The InChIKey is WHIQYHWRLUMPCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c16-14-9-11(17)3-6-13(14)15(20)18-8-7-10-1-4-12(19)5-2-10/h1-6,9,19H,7-8,17H2,(H,18,20).
What are the key properties of 4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide?
4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide has a molecular weight of 290.75 g/mol, XLogP of 2.60, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide is sourced from PubChem (CID 61237813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).