N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide

C16H21NO2 — CID 176516153

IUPACN-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide
SMILESC=Cc1cc(CC(=O)NC2CCCC2)ccc1OC
InChIInChI=1S/C16H21NO2/c1-3-13-10-12(8-9-15(13)19-2)11-16(18)17-14-6-4-5-7-14/h3,8-10,14H,1,4-7,11H2,2H3,(H,17,18)
InChIKeyRDPYUIOHQUCJME-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.94
Rot. Bonds5

About N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide

N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide (PubChem CID 176516153) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide
PubChem CID176516153
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC NameN-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide
SMILESC=Cc1cc(CC(=O)NC2CCCC2)ccc1OC
InChIInChI=1S/C16H21NO2/c1-3-13-10-12(8-9-15(13)19-2)11-16(18)17-14-6-4-5-7-14/h3,8-10,14H,1,4-7,11H2,2H3,(H,17,18)
InChIKeyRDPYUIOHQUCJME-UHFFFAOYSA-N
XLogP2.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide?
The IUPAC name of N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide (CID 176516153) is N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide.
What is the SMILES notation for N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide?
The canonical SMILES for N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide is C=Cc1cc(CC(=O)NC2CCCC2)ccc1OC.
What is the InChIKey of N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide?
The InChIKey is RDPYUIOHQUCJME-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-3-13-10-12(8-9-15(13)19-2)11-16(18)17-14-6-4-5-7-14/h3,8-10,14H,1,4-7,11H2,2H3,(H,17,18).
What are the key properties of N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide?
N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide has a molecular weight of 259.35 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(3-ethenyl-4-methoxyphenyl)acetamide is sourced from PubChem (CID 176516153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).