2-cyclobutyloxy-4-pyridin-3-ylbenzamide

C16H16N2O2 — CID 155536337

IUPAC2-cyclobutyloxy-4-pyridin-3-ylbenzamide
SMILESNC(=O)c1ccc(-c2cccnc2)cc1OC1CCC1
InChIInChI=1S/C16H16N2O2/c17-16(19)14-7-6-11(12-3-2-8-18-10-12)9-15(14)20-13-4-1-5-13/h2-3,6-10,13H,1,4-5H2,(H2,17,19)
InChIKeyNUHBWHIFHLEOFN-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.78
Rot. Bonds4

About 2-cyclobutyloxy-4-pyridin-3-ylbenzamide

2-cyclobutyloxy-4-pyridin-3-ylbenzamide (PubChem CID 155536337) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-cyclobutyloxy-4-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2-cyclobutyloxy-4-pyridin-3-ylbenzamide
PubChem CID155536337
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name2-cyclobutyloxy-4-pyridin-3-ylbenzamide
SMILESNC(=O)c1ccc(-c2cccnc2)cc1OC1CCC1
InChIInChI=1S/C16H16N2O2/c17-16(19)14-7-6-11(12-3-2-8-18-10-12)9-15(14)20-13-4-1-5-13/h2-3,6-10,13H,1,4-5H2,(H2,17,19)
InChIKeyNUHBWHIFHLEOFN-UHFFFAOYSA-N
XLogP2.78
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyloxy-4-pyridin-3-ylbenzamide?
The IUPAC name of 2-cyclobutyloxy-4-pyridin-3-ylbenzamide (CID 155536337) is 2-cyclobutyloxy-4-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-cyclobutyloxy-4-pyridin-3-ylbenzamide?
The canonical SMILES for 2-cyclobutyloxy-4-pyridin-3-ylbenzamide is NC(=O)c1ccc(-c2cccnc2)cc1OC1CCC1.
What is the InChIKey of 2-cyclobutyloxy-4-pyridin-3-ylbenzamide?
The InChIKey is NUHBWHIFHLEOFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c17-16(19)14-7-6-11(12-3-2-8-18-10-12)9-15(14)20-13-4-1-5-13/h2-3,6-10,13H,1,4-5H2,(H2,17,19).
What are the key properties of 2-cyclobutyloxy-4-pyridin-3-ylbenzamide?
2-cyclobutyloxy-4-pyridin-3-ylbenzamide has a molecular weight of 268.32 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyloxy-4-pyridin-3-ylbenzamide is sourced from PubChem (CID 155536337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).