4-cyclopentyl-N-pyridin-4-ylbenzamide

C17H18N2O — CID 110464379

IUPAC4-cyclopentyl-N-pyridin-4-ylbenzamide
SMILESO=C(Nc1ccncc1)c1ccc(C2CCCC2)cc1
InChIInChI=1S/C17H18N2O/c20-17(19-16-9-11-18-12-10-16)15-7-5-14(6-8-15)13-3-1-2-4-13/h5-13H,1-4H2,(H,18,19,20)
InChIKeyUZSKSYKQKSRDAA-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.99
Rot. Bonds3

About 4-cyclopentyl-N-pyridin-4-ylbenzamide

4-cyclopentyl-N-pyridin-4-ylbenzamide (PubChem CID 110464379) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 4-cyclopentyl-N-pyridin-4-ylbenzamide.

Molecular Properties

Compound Name4-cyclopentyl-N-pyridin-4-ylbenzamide
PubChem CID110464379
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name4-cyclopentyl-N-pyridin-4-ylbenzamide
SMILESO=C(Nc1ccncc1)c1ccc(C2CCCC2)cc1
InChIInChI=1S/C17H18N2O/c20-17(19-16-9-11-18-12-10-16)15-7-5-14(6-8-15)13-3-1-2-4-13/h5-13H,1-4H2,(H,18,19,20)
InChIKeyUZSKSYKQKSRDAA-UHFFFAOYSA-N
XLogP3.99
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-pyridin-4-ylbenzamide?
The IUPAC name of 4-cyclopentyl-N-pyridin-4-ylbenzamide (CID 110464379) is 4-cyclopentyl-N-pyridin-4-ylbenzamide.
What is the SMILES notation for 4-cyclopentyl-N-pyridin-4-ylbenzamide?
The canonical SMILES for 4-cyclopentyl-N-pyridin-4-ylbenzamide is O=C(Nc1ccncc1)c1ccc(C2CCCC2)cc1.
What is the InChIKey of 4-cyclopentyl-N-pyridin-4-ylbenzamide?
The InChIKey is UZSKSYKQKSRDAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c20-17(19-16-9-11-18-12-10-16)15-7-5-14(6-8-15)13-3-1-2-4-13/h5-13H,1-4H2,(H,18,19,20).
What are the key properties of 4-cyclopentyl-N-pyridin-4-ylbenzamide?
4-cyclopentyl-N-pyridin-4-ylbenzamide has a molecular weight of 266.34 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-pyridin-4-ylbenzamide is sourced from PubChem (CID 110464379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).