N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide

C17H18N2O2 — CID 154837427

IUPACN-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide
SMILESO=C(Nc1ccc(Oc2ccccn2)cc1)C1CCCC1
InChIInChI=1S/C17H18N2O2/c20-17(13-5-1-2-6-13)19-14-8-10-15(11-9-14)21-16-7-3-4-12-18-16/h3-4,7-13H,1-2,5-6H2,(H,19,20)
InChIKeyWJSJZFWERAQEJT-UHFFFAOYSA-N
MW282.34 g/mol
LogP4.00
Rot. Bonds4

About N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide

N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide (PubChem CID 154837427) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide
PubChem CID154837427
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide
SMILESO=C(Nc1ccc(Oc2ccccn2)cc1)C1CCCC1
InChIInChI=1S/C17H18N2O2/c20-17(13-5-1-2-6-13)19-14-8-10-15(11-9-14)21-16-7-3-4-12-18-16/h3-4,7-13H,1-2,5-6H2,(H,19,20)
InChIKeyWJSJZFWERAQEJT-UHFFFAOYSA-N
XLogP4.00
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide?
The IUPAC name of N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide (CID 154837427) is N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide?
The canonical SMILES for N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide is O=C(Nc1ccc(Oc2ccccn2)cc1)C1CCCC1.
What is the InChIKey of N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide?
The InChIKey is WJSJZFWERAQEJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c20-17(13-5-1-2-6-13)19-14-8-10-15(11-9-14)21-16-7-3-4-12-18-16/h3-4,7-13H,1-2,5-6H2,(H,19,20).
What are the key properties of N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide?
N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide has a molecular weight of 282.34 g/mol, XLogP of 4.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-pyridin-2-yloxyphenyl)cyclopentanecarboxamide is sourced from PubChem (CID 154837427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).