2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide

C19H23ClN2O2 — CID 109002867

IUPAC2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide
SMILESCC(C)Oc1ccccc1NC(=O)CNCCc1ccc(Cl)cc1
InChIInChI=1S/C19H23ClN2O2/c1-14(2)24-18-6-4-3-5-17(18)22-19(23)13-21-12-11-15-7-9-16(20)10-8-15/h3-10,14,21H,11-13H2,1-2H3,(H,22,23)
InChIKeyXUGDSWLDMVETNA-UHFFFAOYSA-N
MW346.86 g/mol
LogP3.90
Rot. Bonds8

About 2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide

2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide (PubChem CID 109002867) has the molecular formula C19H23ClN2O2 and a molecular weight of 346.86 g/mol. Its IUPAC name is 2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide
PubChem CID109002867
Molecular FormulaC19H23ClN2O2
Molecular Weight346.86 g/mol
Exact Mass346.14
IUPAC Name2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide
SMILESCC(C)Oc1ccccc1NC(=O)CNCCc1ccc(Cl)cc1
InChIInChI=1S/C19H23ClN2O2/c1-14(2)24-18-6-4-3-5-17(18)22-19(23)13-21-12-11-15-7-9-16(20)10-8-15/h3-10,14,21H,11-13H2,1-2H3,(H,22,23)
InChIKeyXUGDSWLDMVETNA-UHFFFAOYSA-N
XLogP3.90
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.86
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide
CID 109002864
2-[2-(2-methoxyphenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 109000681
4-chloro-N-[2-oxo-2-(2-propan-2-yloxyanilino)ethyl]benzamide
CID 112999004
2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride
CID 119714872
3-(4-chloroanilino)-N-(2-propan-2-yloxyphenyl)propanamide
CID 109038195
N'-(2-chlorophenyl)-N-(2-propan-2-yloxyphenyl)propanediamide
CID 108954883
N'-(2-propan-2-yloxyphenyl)-N-(2,3,4-trifluorophenyl)propanediamide
CID 108955874
N'-(2-fluorophenyl)-N-(2-propan-2-yloxyphenyl)propanediamide
CID 108954759
N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide
CID 108955532
2-[2-(4-chlorophenyl)ethylamino]-N-(4-propan-2-ylphenyl)acetamide
CID 109002847
2-(3-chloro-2-methylanilino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 54812884
2-[2-(4-chlorophenyl)ethylamino]-N-(2,5-dimethoxyphenyl)acetamide
CID 109002869

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide?
The IUPAC name of 2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide (CID 109002867) is 2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for 2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for 2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide is CC(C)Oc1ccccc1NC(=O)CNCCc1ccc(Cl)cc1.
What is the InChIKey of 2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide?
The InChIKey is XUGDSWLDMVETNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O2/c1-14(2)24-18-6-4-3-5-17(18)22-19(23)13-21-12-11-15-7-9-16(20)10-8-15/h3-10,14,21H,11-13H2,1-2H3,(H,22,23).
What are the key properties of 2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide?
2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide has a molecular weight of 346.86 g/mol, XLogP of 3.90, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 109002867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).