4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide

C22H20N2O3 — CID 68539937

IUPAC4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide
SMILESCCc1ccc(C(=O)NC(=O)Cc2ccc(Oc3ccncc3)cc2)cc1
InChIInChI=1S/C22H20N2O3/c1-2-16-3-7-18(8-4-16)22(26)24-21(25)15-17-5-9-19(10-6-17)27-20-11-13-23-14-12-20/h3-14H,2,15H2,1H3,(H,24,25,26)
InChIKeyZIYAWKGSDKHXRB-UHFFFAOYSA-N
MW360.41 g/mol
LogP3.94
Rot. Bonds6

About 4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide

4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide (PubChem CID 68539937) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is 4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide.

Molecular Properties

Compound Name4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide
PubChem CID68539937
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC Name4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide
SMILESCCc1ccc(C(=O)NC(=O)Cc2ccc(Oc3ccncc3)cc2)cc1
InChIInChI=1S/C22H20N2O3/c1-2-16-3-7-18(8-4-16)22(26)24-21(25)15-17-5-9-19(10-6-17)27-20-11-13-23-14-12-20/h3-14H,2,15H2,1H3,(H,24,25,26)
InChIKeyZIYAWKGSDKHXRB-UHFFFAOYSA-N
XLogP3.94
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-pyridin-4-yloxyphenyl)acetic acid
CID 61395502
4-ethyl-N-pyridin-4-ylbenzamide
CID 2712552
2-(4-pyridin-4-yloxyphenyl)acetic acid;hydrochloride
CID 71756945
2-(4-ethylphenyl)-1-(4-phenoxyphenyl)ethanone
CID 158282990
N'-[2-(4-ethoxyphenyl)acetyl]-4-ethylbenzohydrazide
CID 78780592
N-[N-(4-ethylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]-4-methoxybenzamide
CID 50773171
4-ethyl-N-(2-pyridin-4-ylethyl)benzamide
CID 70990816
4-ethoxy-N-[N-(4-ethylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide
CID 50773412
4-ethyl-N-[[4-(pyridin-4-ylmethyl)phenyl]carbamothioyl]benzamide
CID 1317508
N-[2-(4-ethylphenyl)ethyl]pyridine-4-carboxamide
CID 110787242
2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide
CID 957282
4-(4-fluorophenoxy)-N-(pyridin-4-ylmethyl)benzamide
CID 24517908

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide?
The IUPAC name of 4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide (CID 68539937) is 4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide.
What is the SMILES notation for 4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide?
The canonical SMILES for 4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide is CCc1ccc(C(=O)NC(=O)Cc2ccc(Oc3ccncc3)cc2)cc1.
What is the InChIKey of 4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide?
The InChIKey is ZIYAWKGSDKHXRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-2-16-3-7-18(8-4-16)22(26)24-21(25)15-17-5-9-19(10-6-17)27-20-11-13-23-14-12-20/h3-14H,2,15H2,1H3,(H,24,25,26).
What are the key properties of 4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide?
4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide has a molecular weight of 360.41 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-(4-pyridin-4-yloxyphenyl)acetyl]benzamide is sourced from PubChem (CID 68539937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).