1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide

C15H21NO3 — CID 100729423

IUPAC1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide
SMILESCCOC1(C(=O)Nc2ccc(OC)cc2)CCCC1
InChIInChI=1S/C15H21NO3/c1-3-19-15(10-4-5-11-15)14(17)16-12-6-8-13(18-2)9-7-12/h6-9H,3-5,10-11H2,1-2H3,(H,16,17)
InChIKeyYCIWHNBQGKUARY-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.98
Rot. Bonds5

About 1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide

1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide (PubChem CID 100729423) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide
PubChem CID100729423
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide
SMILESCCOC1(C(=O)Nc2ccc(OC)cc2)CCCC1
InChIInChI=1S/C15H21NO3/c1-3-19-15(10-4-5-11-15)14(17)16-12-6-8-13(18-2)9-7-12/h6-9H,3-5,10-11H2,1-2H3,(H,16,17)
InChIKeyYCIWHNBQGKUARY-UHFFFAOYSA-N
XLogP2.98
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide (CID 100729423) is 1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide is CCOC1(C(=O)Nc2ccc(OC)cc2)CCCC1.
What is the InChIKey of 1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide?
The InChIKey is YCIWHNBQGKUARY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-3-19-15(10-4-5-11-15)14(17)16-12-6-8-13(18-2)9-7-12/h6-9H,3-5,10-11H2,1-2H3,(H,16,17).
What are the key properties of 1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide?
1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N-(4-methoxyphenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 100729423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).