(2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide

C20H23NO3 — CID 8604722

IUPAC(2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide
SMILESCCC(=O)c1ccc(O[C@@H](C)C(=O)Nc2ccc(CC)cc2)cc1
InChIInChI=1S/C20H23NO3/c1-4-15-6-10-17(11-7-15)21-20(23)14(3)24-18-12-8-16(9-13-18)19(22)5-2/h6-14H,4-5H2,1-3H3,(H,21,23)/t14-/m0/s1
InChIKeyMOVRECQZQAOIIW-AWEZNQCLSA-N
MW325.41 g/mol
LogP4.25
Rot. Bonds7

About (2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide

(2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide (PubChem CID 8604722) has the molecular formula C20H23NO3 and a molecular weight of 325.41 g/mol. Its IUPAC name is (2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide.

Molecular Properties

Compound Name(2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide
PubChem CID8604722
Molecular FormulaC20H23NO3
Molecular Weight325.41 g/mol
Exact Mass325.17
IUPAC Name(2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide
SMILESCCC(=O)c1ccc(O[C@@H](C)C(=O)Nc2ccc(CC)cc2)cc1
InChIInChI=1S/C20H23NO3/c1-4-15-6-10-17(11-7-15)21-20(23)14(3)24-18-12-8-16(9-13-18)19(22)5-2/h6-14H,4-5H2,1-3H3,(H,21,23)/t14-/m0/s1
InChIKeyMOVRECQZQAOIIW-AWEZNQCLSA-N
XLogP4.25
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-(4-ethylphenoxy)propanamide
CID 4953258
(2R)-N-(4-bromophenyl)-2-(4-propanoylphenoxy)propanamide
CID 7788127
N-ethyl-4-[2-(4-ethylphenoxy)propanoylamino]benzamide
CID 17234371
2-(4-bromophenoxy)-N-(4-ethylphenyl)propanamide
CID 132791420
(2S)-2-(4-tert-butylphenoxy)-N-(4-ethylphenyl)propanamide
CID 7703328
4-[1-(4-ethylanilino)-1-oxopropan-2-yl]oxy-N-(4-fluorophenyl)benzamide
CID 3691715
4-[2-(4-ethylphenoxy)propanoylamino]-N,N-dipropylbenzamide
CID 17196211
N-[4-[[[(2S)-2-(4-ethylphenoxy)propanoyl]amino]carbamoyl]phenyl]propanamide
CID 9237602
(2S)-2-(4-ethylphenoxy)-N-[4-(2-methylpropoxy)phenyl]propanamide
CID 9237321
N-[4-(diethylamino)phenyl]-2-(4-ethylphenoxy)propanamide
CID 4953277
N-(4-ethylphenyl)-2-(4-formylphenoxy)propanamide
CID 23409645
2-methyl-N-[4-[(2R)-2-(4-propanoylphenoxy)propanoyl]phenyl]propanamide
CID 39949041

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide?
The IUPAC name of (2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide (CID 8604722) is (2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide.
What is the SMILES notation for (2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide?
The canonical SMILES for (2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide is CCC(=O)c1ccc(O[C@@H](C)C(=O)Nc2ccc(CC)cc2)cc1.
What is the InChIKey of (2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide?
The InChIKey is MOVRECQZQAOIIW-AWEZNQCLSA-N. The full InChI is InChI=1S/C20H23NO3/c1-4-15-6-10-17(11-7-15)21-20(23)14(3)24-18-12-8-16(9-13-18)19(22)5-2/h6-14H,4-5H2,1-3H3,(H,21,23)/t14-/m0/s1.
What are the key properties of (2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide?
(2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide has a molecular weight of 325.41 g/mol, XLogP of 4.25, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(4-ethylphenyl)-2-(4-propanoylphenoxy)propanamide is sourced from PubChem (CID 8604722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).