4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide

C25H26N2O3 — CID 54166199

IUPAC4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide
SMILESCCc1ccc(C(=O)NC[C@H](NC(=O)c2ccc(OC)cc2)c2ccccc2)cc1
InChIInChI=1S/C25H26N2O3/c1-3-18-9-11-20(12-10-18)24(28)26-17-23(19-7-5-4-6-8-19)27-25(29)21-13-15-22(30-2)16-14-21/h4-16,23H,3,17H2,1-2H3,(H,26,28)(H,27,29)/t23-/m0/s1
InChIKeyORUOKMGEGDUQHM-QHCPKHFHSA-N
MW402.49 g/mol
LogP4.16
Rot. Bonds8

About 4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide

4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide (PubChem CID 54166199) has the molecular formula C25H26N2O3 and a molecular weight of 402.49 g/mol. Its IUPAC name is 4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide.

Molecular Properties

Compound Name4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide
PubChem CID54166199
Molecular FormulaC25H26N2O3
Molecular Weight402.49 g/mol
Exact Mass402.19
IUPAC Name4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide
SMILESCCc1ccc(C(=O)NC[C@H](NC(=O)c2ccc(OC)cc2)c2ccccc2)cc1
InChIInChI=1S/C25H26N2O3/c1-3-18-9-11-20(12-10-18)24(28)26-17-23(19-7-5-4-6-8-19)27-25(29)21-13-15-22(30-2)16-14-21/h4-16,23H,3,17H2,1-2H3,(H,26,28)(H,27,29)/t23-/m0/s1
InChIKeyORUOKMGEGDUQHM-QHCPKHFHSA-N
XLogP4.16
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.49
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-[(1S)-2-hydroxy-1-phenylethyl]benzamide
CID 103945042
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CID 114296068
4-methoxy-N-[(1S)-1-phenylbut-3-ynyl]benzamide
CID 97063453
4-methoxy-N-[1-(4-methoxyphenyl)propyl]benzamide
CID 43904504
[4-(1-phenylethylcarbamoyl)phenyl] 4-ethylbenzoate
CID 23597756
4-ethyl-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide
CID 90623280
N-[2-[(4-methoxybenzoyl)amino]-2-phenylethyl]-1-propan-2-ylpiperidine-4-carboxamide
CID 22134907
4-ethyl-N-[(2S)-2-hydroxy-3-[(4-methoxyphenyl)methoxy]propyl]benzamide
CID 95344832
N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide
CID 38002269
[2-(4-methoxyphenyl)-2-oxoethyl] (3S)-3-benzamido-3-phenylpropanoate
CID 7214914
1-(4-ethylphenyl)-3-(4-methoxyphenyl)propane-1,3-dione
CID 18428800
1-N,4-N-bis(1-phenylpropyl)benzene-1,4-dicarboxamide
CID 43912072

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide?
The IUPAC name of 4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide (CID 54166199) is 4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide.
What is the SMILES notation for 4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide?
The canonical SMILES for 4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide is CCc1ccc(C(=O)NC[C@H](NC(=O)c2ccc(OC)cc2)c2ccccc2)cc1.
What is the InChIKey of 4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide?
The InChIKey is ORUOKMGEGDUQHM-QHCPKHFHSA-N. The full InChI is InChI=1S/C25H26N2O3/c1-3-18-9-11-20(12-10-18)24(28)26-17-23(19-7-5-4-6-8-19)27-25(29)21-13-15-22(30-2)16-14-21/h4-16,23H,3,17H2,1-2H3,(H,26,28)(H,27,29)/t23-/m0/s1.
What are the key properties of 4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide?
4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide has a molecular weight of 402.49 g/mol, XLogP of 4.16, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylethyl]benzamide is sourced from PubChem (CID 54166199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).