N-octyl-3-pyridin-2-yloxybenzamide

C20H26N2O2 — CID 90596511

IUPACN-octyl-3-pyridin-2-yloxybenzamide
SMILESCCCCCCCCNC(=O)c1cccc(Oc2ccccn2)c1
InChIInChI=1S/C20H26N2O2/c1-2-3-4-5-6-8-15-22-20(23)17-11-10-12-18(16-17)24-19-13-7-9-14-21-19/h7,9-14,16H,2-6,8,15H2,1H3,(H,22,23)
InChIKeyGZEZSHNTINQPNF-UHFFFAOYSA-N
MW326.44 g/mol
LogP4.96
Rot. Bonds10

About N-octyl-3-pyridin-2-yloxybenzamide

N-octyl-3-pyridin-2-yloxybenzamide (PubChem CID 90596511) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is N-octyl-3-pyridin-2-yloxybenzamide.

Molecular Properties

Compound NameN-octyl-3-pyridin-2-yloxybenzamide
PubChem CID90596511
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC NameN-octyl-3-pyridin-2-yloxybenzamide
SMILESCCCCCCCCNC(=O)c1cccc(Oc2ccccn2)c1
InChIInChI=1S/C20H26N2O2/c1-2-3-4-5-6-8-15-22-20(23)17-11-10-12-18(16-17)24-19-13-7-9-14-21-19/h7,9-14,16H,2-6,8,15H2,1H3,(H,22,23)
InChIKeyGZEZSHNTINQPNF-UHFFFAOYSA-N
XLogP4.96
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-octyl-3-pyridin-2-yloxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-hexyl-3-pyridin-2-yloxybenzamide
CID 90596510
N-pentyl-3-(6-phenylpyrimidin-4-yl)oxybenzamide
CID 53021376
3-methoxy-N-tridecylbenzamide
CID 139819898
3-[6-(4-methoxyphenyl)pyrimidin-4-yl]oxy-N-pentylbenzamide
CID 53011517
N-pentyl-3-phenylmethoxybenzamide
CID 112759707
[3-(pentylcarbamoyl)phenyl] acetate
CID 89122347
3-(2-ethoxyethoxy)-N-hexadecylbenzamide
CID 17139521
N-[2-(cyclohexen-1-yl)ethyl]-3-pyridin-2-yloxybenzamide
CID 71809890
N-(2,3-dihydro-1H-inden-2-yl)-3-pyridin-2-yloxybenzamide
CID 90596546
N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide
CID 119506992
3-propoxy-N-[3-[(3-propoxybenzoyl)amino]propyl]benzamide
CID 4960565
N-octylquinoline-6-carboxamide
CID 68863650

Frequently Asked Questions

What is the IUPAC name of N-octyl-3-pyridin-2-yloxybenzamide?
The IUPAC name of N-octyl-3-pyridin-2-yloxybenzamide (CID 90596511) is N-octyl-3-pyridin-2-yloxybenzamide.
What is the SMILES notation for N-octyl-3-pyridin-2-yloxybenzamide?
The canonical SMILES for N-octyl-3-pyridin-2-yloxybenzamide is CCCCCCCCNC(=O)c1cccc(Oc2ccccn2)c1.
What is the InChIKey of N-octyl-3-pyridin-2-yloxybenzamide?
The InChIKey is GZEZSHNTINQPNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-2-3-4-5-6-8-15-22-20(23)17-11-10-12-18(16-17)24-19-13-7-9-14-21-19/h7,9-14,16H,2-6,8,15H2,1H3,(H,22,23).
What are the key properties of N-octyl-3-pyridin-2-yloxybenzamide?
N-octyl-3-pyridin-2-yloxybenzamide has a molecular weight of 326.44 g/mol, XLogP of 4.96, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-octyl-3-pyridin-2-yloxybenzamide is sourced from PubChem (CID 90596511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).