N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide

C19H23NO2 — CID 885698

IUPACN-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide
SMILESCOc1ccc(CCNC(=O)CCCc2ccccc2)cc1
InChIInChI=1S/C19H23NO2/c1-22-18-12-10-17(11-13-18)14-15-20-19(21)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-13H,5,8-9,14-15H2,1H3,(H,20,21)
InChIKeyOGAFYCVELKMZTQ-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.38
Rot. Bonds8

About N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide

N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide (PubChem CID 885698) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide
PubChem CID885698
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide
SMILESCOc1ccc(CCNC(=O)CCCc2ccccc2)cc1
InChIInChI=1S/C19H23NO2/c1-22-18-12-10-17(11-13-18)14-15-20-19(21)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-13H,5,8-9,14-15H2,1H3,(H,20,21)
InChIKeyOGAFYCVELKMZTQ-UHFFFAOYSA-N
XLogP3.38
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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(9Z,12Z)-N-(3-Methoxybenzyl)Octadeca-9,12-Dienamide
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Propanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071631
Butanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071652
N-[3-(3-methoxyphenyl)propyl]acetamide
CID 10750842
N-[(6-Methoxy-9-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)methyl]acetamide
CID 11185529
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
4-methoxy-N-(2-oxo-2-phenylethyl)benzamide
CID 796649
3,4-Dimethoxy-N-(phenylmethyl)benzeneacetamide
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CID 2877039

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide?
The IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide (CID 885698) is N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide.
What is the SMILES notation for N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide?
The canonical SMILES for N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide is COc1ccc(CCNC(=O)CCCc2ccccc2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide?
The InChIKey is OGAFYCVELKMZTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-22-18-12-10-17(11-13-18)14-15-20-19(21)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-13H,5,8-9,14-15H2,1H3,(H,20,21).
What are the key properties of N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide?
N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide has a molecular weight of 297.40 g/mol, XLogP of 3.38, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutanamide is sourced from PubChem (CID 885698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).