N-[1-(4-methoxyphenyl)ethyl]benzamide

C16H17NO2 — CID 2854145

IUPACN-[1-(4-methoxyphenyl)ethyl]benzamide
SMILESCOc1ccc(C(C)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C16H17NO2/c1-12(13-8-10-15(19-2)11-9-13)17-16(18)14-6-4-3-5-7-14/h3-12H,1-2H3,(H,17,18)
InChIKeyCPICQDAXAGSODF-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.19
Rot. Bonds4

About N-[1-(4-methoxyphenyl)ethyl]benzamide

N-[1-(4-methoxyphenyl)ethyl]benzamide (PubChem CID 2854145) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)ethyl]benzamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)ethyl]benzamide
PubChem CID2854145
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC NameN-[1-(4-methoxyphenyl)ethyl]benzamide
SMILESCOc1ccc(C(C)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C16H17NO2/c1-12(13-8-10-15(19-2)11-9-13)17-16(18)14-6-4-3-5-7-14/h3-12H,1-2H3,(H,17,18)
InChIKeyCPICQDAXAGSODF-UHFFFAOYSA-N
XLogP3.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)ethyl]benzamide?
The IUPAC name of N-[1-(4-methoxyphenyl)ethyl]benzamide (CID 2854145) is N-[1-(4-methoxyphenyl)ethyl]benzamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)ethyl]benzamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)ethyl]benzamide is COc1ccc(C(C)NC(=O)c2ccccc2)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)ethyl]benzamide?
The InChIKey is CPICQDAXAGSODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-12(13-8-10-15(19-2)11-9-13)17-16(18)14-6-4-3-5-7-14/h3-12H,1-2H3,(H,17,18).
What are the key properties of N-[1-(4-methoxyphenyl)ethyl]benzamide?
N-[1-(4-methoxyphenyl)ethyl]benzamide has a molecular weight of 255.32 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)ethyl]benzamide is sourced from PubChem (CID 2854145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).