2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide

C17H17ClN2O3 — CID 7199656

IUPAC2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide
SMILESC[C@@H](NC(=O)COc1ccccc1C(N)=O)c1ccc(Cl)cc1
InChIInChI=1S/C17H17ClN2O3/c1-11(12-6-8-13(18)9-7-12)20-16(21)10-23-15-5-3-2-4-14(15)17(19)22/h2-9,11H,10H2,1H3,(H2,19,22)(H,20,21)/t11-/m1/s1
InChIKeyXXJPXGXVXNDVHU-LLVKDONJSA-N
MW332.79 g/mol
LogP2.70
Rot. Bonds6

About 2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide

2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide (PubChem CID 7199656) has the molecular formula C17H17ClN2O3 and a molecular weight of 332.79 g/mol. Its IUPAC name is 2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide
PubChem CID7199656
Molecular FormulaC17H17ClN2O3
Molecular Weight332.79 g/mol
Exact Mass332.09
IUPAC Name2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide
SMILESC[C@@H](NC(=O)COc1ccccc1C(N)=O)c1ccc(Cl)cc1
InChIInChI=1S/C17H17ClN2O3/c1-11(12-6-8-13(18)9-7-12)20-16(21)10-23-15-5-3-2-4-14(15)17(19)22/h2-9,11H,10H2,1H3,(H2,19,22)(H,20,21)/t11-/m1/s1
InChIKeyXXJPXGXVXNDVHU-LLVKDONJSA-N
XLogP2.70
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.79
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethoxy]benzamide
CID 8866061
2-[2-[[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]amino]-2-oxoethoxy]benzamide
CID 7283926
2-[2-[[(S)-(4-chlorophenyl)-phenylmethyl]amino]-2-oxoethoxy]benzamide
CID 8851691
2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide
CID 4884296
2-[2-oxo-2-[1-(1H-pyrazol-4-yl)ethylamino]ethoxy]benzamide
CID 106217638
N-[1-(4-chlorophenyl)ethyl]-2-[2-(hydroxymethyl)phenoxy]acetamide
CID 110891946
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(2-phenylphenoxy)acetamide
CID 7948811
(2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid
CID 54991568
2-[2-[[(1R)-1-(2-bromophenyl)ethyl]amino]-2-oxoethoxy]benzamide
CID 9090585
2-O-[2-[1-(4-chlorophenyl)ethylamino]-2-oxoethyl] 1-O-methyl benzene-1,2-dicarboxylate
CID 56506418
N-[1-(4-chlorophenyl)ethyl]-2-[2-(2-fluoroanilino)-2-oxoethoxy]benzamide
CID 112761405
2-(2-chlorophenoxy)-N-(1-phenylethyl)acetamide
CID 2787215

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide?
The IUPAC name of 2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide (CID 7199656) is 2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide.
What is the SMILES notation for 2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide?
The canonical SMILES for 2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide is C[C@@H](NC(=O)COc1ccccc1C(N)=O)c1ccc(Cl)cc1.
What is the InChIKey of 2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide?
The InChIKey is XXJPXGXVXNDVHU-LLVKDONJSA-N. The full InChI is InChI=1S/C17H17ClN2O3/c1-11(12-6-8-13(18)9-7-12)20-16(21)10-23-15-5-3-2-4-14(15)17(19)22/h2-9,11H,10H2,1H3,(H2,19,22)(H,20,21)/t11-/m1/s1.
What are the key properties of 2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide?
2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide has a molecular weight of 332.79 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide is sourced from PubChem (CID 7199656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).