N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide

C18H21ClN2O2 — CID 120885508

IUPACN-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide
SMILESNCCN(CCc1ccccc1)C(=O)COc1ccccc1Cl
InChIInChI=1S/C18H21ClN2O2/c19-16-8-4-5-9-17(16)23-14-18(22)21(13-11-20)12-10-15-6-2-1-3-7-15/h1-9H,10-14,20H2
InChIKeyGQHMUJLBWRBMMZ-UHFFFAOYSA-N
MW332.83 g/mol
LogP2.75
Rot. Bonds8

About N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide

N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide (PubChem CID 120885508) has the molecular formula C18H21ClN2O2 and a molecular weight of 332.83 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide
PubChem CID120885508
Molecular FormulaC18H21ClN2O2
Molecular Weight332.83 g/mol
Exact Mass332.13
IUPAC NameN-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide
SMILESNCCN(CCc1ccccc1)C(=O)COc1ccccc1Cl
InChIInChI=1S/C18H21ClN2O2/c19-16-8-4-5-9-17(16)23-14-18(22)21(13-11-20)12-10-15-6-2-1-3-7-15/h1-9H,10-14,20H2
InChIKeyGQHMUJLBWRBMMZ-UHFFFAOYSA-N
XLogP2.75
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.83
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-2-(2-ethoxyphenoxy)-N-(2-phenylethyl)acetamide
CID 120884950
N-(2-aminoethyl)-2-(2-fluorophenoxy)-N-(2-phenylethyl)acetamide;hydrochloride
CID 120884947
N-(2-aminoethyl)-2-(2,4-difluorophenoxy)-N-(2-phenylethyl)acetamide
CID 120886664
N-(2-aminoethyl)-2-(2-chlorophenyl)-N-(2-phenylethyl)acetamide;hydrochloride
CID 120885855
N-(2-aminoethyl)-N-(2-phenylethyl)propanamide
CID 120884412
N-(2-aminoethyl)-2-ethoxy-N-(2-phenylethyl)acetamide;hydrochloride
CID 120886517
N-(2-aminoethyl)-2-(4-chlorophenyl)-N-(2-phenylethyl)acetamide;hydrochloride
CID 120887035
2-(3-acetylphenoxy)-N-(2-aminoethyl)-N-(2-phenylethyl)acetamide
CID 120884790
N-(2-aminoethyl)-N-(2-phenylethyl)-2-(2,2,2-trifluoroethoxy)acetamide;hydrochloride
CID 120884359
N-(2-aminoethyl)-2-(2,6-dimethoxyphenyl)-N-(2-phenylethyl)acetamide
CID 120885592
2-(2,4-dichlorophenoxy)-N-(2-phenylethyl)-N-(pyridin-2-ylmethyl)acetamide
CID 56764008
2-[[2-(2-chlorophenoxy)acetyl]-(2-phenylethyl)amino]-N-propan-2-ylbutanamide
CID 132708443

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide?
The IUPAC name of N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide (CID 120885508) is N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide?
The canonical SMILES for N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide is NCCN(CCc1ccccc1)C(=O)COc1ccccc1Cl.
What is the InChIKey of N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide?
The InChIKey is GQHMUJLBWRBMMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN2O2/c19-16-8-4-5-9-17(16)23-14-18(22)21(13-11-20)12-10-15-6-2-1-3-7-15/h1-9H,10-14,20H2.
What are the key properties of N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide?
N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide has a molecular weight of 332.83 g/mol, XLogP of 2.75, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-(2-chlorophenoxy)-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 120885508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).