N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide

C15H15ClN2O2 — CID 18071163

IUPACN-(3-amino-4-chlorophenyl)-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)Nc2ccc(Cl)c(N)c2)cc1
InChIInChI=1S/C15H15ClN2O2/c1-2-20-12-6-3-10(4-7-12)15(19)18-11-5-8-13(16)14(17)9-11/h3-9H,2,17H2,1H3,(H,18,19)
InChIKeyODROSXJGICEINC-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.57
Rot. Bonds4

About N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide

N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide (PubChem CID 18071163) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide.

Molecular Properties

Compound NameN-(3-amino-4-chlorophenyl)-4-ethoxybenzamide
PubChem CID18071163
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC NameN-(3-amino-4-chlorophenyl)-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)Nc2ccc(Cl)c(N)c2)cc1
InChIInChI=1S/C15H15ClN2O2/c1-2-20-12-6-3-10(4-7-12)15(19)18-11-5-8-13(16)14(17)9-11/h3-9H,2,17H2,1H3,(H,18,19)
InChIKeyODROSXJGICEINC-UHFFFAOYSA-N
XLogP3.57
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-amino-4-chloro-N-(3-ethoxyphenyl)benzamide
CID 60926921
N-(3-amino-4-chlorophenyl)-2-(4-ethoxyphenyl)acetamide
CID 28866983
N-(3,4-dichlorophenyl)-4-propoxybenzamide
CID 4938387
N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide
CID 23464410
3-amino-4-chloro-N-(4-ethoxy-2-methylphenyl)benzamide
CID 60928289
N-(3,4-dichlorophenyl)-4-hexoxybenzamide
CID 4933556
N-(3-amino-4-chlorophenyl)-4-methylsulfanylbenzamide
CID 78984406
4-amino-N-(4-ethoxyphenyl)-3-fluorobenzamide
CID 62679243
4-ethoxy-N-(4-hydroxyphenyl)benzamide
CID 13388921
N-(6-chloro-3-pyridinyl)-4-ethoxybenzamide
CID 54787908
N-(2-amino-4-ethoxyphenyl)-4-ethoxybenzamide
CID 91687646
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide
CID 7929215

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide?
The IUPAC name of N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide (CID 18071163) is N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide.
What is the SMILES notation for N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide?
The canonical SMILES for N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide is CCOc1ccc(C(=O)Nc2ccc(Cl)c(N)c2)cc1.
What is the InChIKey of N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide?
The InChIKey is ODROSXJGICEINC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-2-20-12-6-3-10(4-7-12)15(19)18-11-5-8-13(16)14(17)9-11/h3-9H,2,17H2,1H3,(H,18,19).
What are the key properties of N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide?
N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide has a molecular weight of 290.75 g/mol, XLogP of 3.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide is sourced from PubChem (CID 18071163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).