4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide

C18H20N2O3 — CID 8608037

IUPAC4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide
SMILESCCN(C(=O)[C@@H](C)Oc1ccc(C(N)=O)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O3/c1-3-20(15-7-5-4-6-8-15)18(22)13(2)23-16-11-9-14(10-12-16)17(19)21/h4-13H,3H2,1-2H3,(H2,19,21)/t13-/m1/s1
InChIKeyAUPJAYDJASSGGJ-CYBMUJFWSA-N
MW312.37 g/mol
LogP2.61
Rot. Bonds6

About 4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide

4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide (PubChem CID 8608037) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide.

Molecular Properties

Compound Name4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide
PubChem CID8608037
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide
SMILESCCN(C(=O)[C@@H](C)Oc1ccc(C(N)=O)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O3/c1-3-20(15-7-5-4-6-8-15)18(22)13(2)23-16-11-9-14(10-12-16)17(19)21/h4-13H,3H2,1-2H3,(H2,19,21)/t13-/m1/s1
InChIKeyAUPJAYDJASSGGJ-CYBMUJFWSA-N
XLogP2.61
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-ethyl-2-phenoxy-N-phenylpropanamide
CID 670227
2-phenoxy-N-[2-[N-(2-phenoxypropanoyl)anilino]ethyl]-N-phenylpropanamide
CID 4940214
[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl] (2S)-2-(4-cyanophenoxy)propanoate
CID 7983913
4-(difluoromethoxy)-N-ethyl-N-phenylbenzamide
CID 78793978
N-ethyl-2-phenoxy-N-phenylbutanamide
CID 4132728
N-[ethyl(phenyl)carbamothioyl]-4-propan-2-yloxybenzamide
CID 4952165
4-[(2R)-1-oxo-1-[[(2S)-4-phenylbutan-2-yl]amino]propan-2-yl]oxybenzamide
CID 31017501
1-N,4-N-bis(2-phenoxypropanoyl)benzene-1,4-dicarbohydrazide
CID 137456577
2-(2-methoxyphenoxy)-N-[2-[N-[2-(2-methoxyphenoxy)propanoyl]anilino]ethyl]-N-phenylpropanamide
CID 4943546
(2S)-N-(furan-2-ylmethyl)-2-(4-methoxyphenoxy)-N-phenylpropanamide
CID 51930010
[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl] 2-benzamidoacetate
CID 7783257
3-[4-[1-(3-chloro-N-ethylanilino)-1-oxopropan-2-yl]oxyphenyl]-2-ethoxypropanoic acid
CID 21102606

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide?
The IUPAC name of 4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide (CID 8608037) is 4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide.
What is the SMILES notation for 4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide?
The canonical SMILES for 4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide is CCN(C(=O)[C@@H](C)Oc1ccc(C(N)=O)cc1)c1ccccc1.
What is the InChIKey of 4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide?
The InChIKey is AUPJAYDJASSGGJ-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-3-20(15-7-5-4-6-8-15)18(22)13(2)23-16-11-9-14(10-12-16)17(19)21/h4-13H,3H2,1-2H3,(H2,19,21)/t13-/m1/s1.
What are the key properties of 4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide?
4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide has a molecular weight of 312.37 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-1-(N-ethylanilino)-1-oxopropan-2-yl]oxybenzamide is sourced from PubChem (CID 8608037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).