(2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide

C23H23NO3 — CID 40770254

IUPAC(2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide
SMILESCCOc1ccccc1NC(=O)[C@H](C)Oc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H23NO3/c1-3-26-22-12-8-7-11-21(22)24-23(25)17(2)27-20-15-13-19(14-16-20)18-9-5-4-6-10-18/h4-17H,3H2,1-2H3,(H,24,25)/t17-/m0/s1
InChIKeyNBXGCHSZWUEGKF-KRWDZBQOSA-N
MW361.44 g/mol
LogP5.16
Rot. Bonds7

About (2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide

(2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide (PubChem CID 40770254) has the molecular formula C23H23NO3 and a molecular weight of 361.44 g/mol. Its IUPAC name is (2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide.

Molecular Properties

Compound Name(2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide
PubChem CID40770254
Molecular FormulaC23H23NO3
Molecular Weight361.44 g/mol
Exact Mass361.17
IUPAC Name(2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide
SMILESCCOc1ccccc1NC(=O)[C@H](C)Oc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H23NO3/c1-3-26-22-12-8-7-11-21(22)24-23(25)17(2)27-20-15-13-19(14-16-20)18-9-5-4-6-10-18/h4-17H,3H2,1-2H3,(H,24,25)/t17-/m0/s1
InChIKeyNBXGCHSZWUEGKF-KRWDZBQOSA-N
XLogP5.16
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.44
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylphenyl)-2-(4-phenylphenoxy)propanamide
CID 19191511
N-[2-(4-ethoxyphenoxy)phenyl]-2-phenoxypropanamide
CID 18170387
(2R)-2-(3,5-dimethylphenoxy)-N-(2-ethoxyphenyl)propanamide
CID 890147
N-(2-butoxyphenyl)-2-(4-methylphenoxy)propanamide
CID 17087052
N-(2-ethoxyphenyl)-4-[1-(2-fluoroanilino)-1-oxopropan-2-yl]oxybenzamide
CID 156704842
N-(2-chlorophenyl)-4-[1-(2-ethoxyanilino)-1-oxopropan-2-yl]oxybenzamide
CID 2968671
(2R)-N-(2-ethoxyphenyl)-2-(2-methylphenoxy)propanamide
CID 837498
2-(3-bromophenoxy)-N-(2-ethoxyphenyl)propanamide
CID 3670954
(2R)-2-(3-bromophenoxy)-N-(2-ethoxyphenyl)propanamide
CID 1177379
N-(2-butoxyphenyl)-2-(4-chlorophenoxy)propanamide
CID 17087061
N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)acetamide
CID 7919529
1-(2-ethoxyphenyl)-3-(4-phenylphenyl)urea
CID 108867158

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide?
The IUPAC name of (2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide (CID 40770254) is (2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide.
What is the SMILES notation for (2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide?
The canonical SMILES for (2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide is CCOc1ccccc1NC(=O)[C@H](C)Oc1ccc(-c2ccccc2)cc1.
What is the InChIKey of (2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide?
The InChIKey is NBXGCHSZWUEGKF-KRWDZBQOSA-N. The full InChI is InChI=1S/C23H23NO3/c1-3-26-22-12-8-7-11-21(22)24-23(25)17(2)27-20-15-13-19(14-16-20)18-9-5-4-6-10-18/h4-17H,3H2,1-2H3,(H,24,25)/t17-/m0/s1.
What are the key properties of (2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide?
(2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide has a molecular weight of 361.44 g/mol, XLogP of 5.16, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)propanamide is sourced from PubChem (CID 40770254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).