3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide

C17H12ClN3O2 — CID 58349181

IUPAC3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide
SMILESO=C(Nc1cccc(Oc2cccnc2)n1)c1cccc(Cl)c1
InChIInChI=1S/C17H12ClN3O2/c18-13-5-1-4-12(10-13)17(22)21-15-7-2-8-16(20-15)23-14-6-3-9-19-11-14/h1-11H,(H,20,21,22)
InChIKeyGVYDDJHUGHDTMI-UHFFFAOYSA-N
MW325.76 g/mol
LogP4.17
Rot. Bonds4

About 3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide

3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide (PubChem CID 58349181) has the molecular formula C17H12ClN3O2 and a molecular weight of 325.76 g/mol. Its IUPAC name is 3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide
PubChem CID58349181
Molecular FormulaC17H12ClN3O2
Molecular Weight325.76 g/mol
Exact Mass325.06
IUPAC Name3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide
SMILESO=C(Nc1cccc(Oc2cccnc2)n1)c1cccc(Cl)c1
InChIInChI=1S/C17H12ClN3O2/c18-13-5-1-4-12(10-13)17(22)21-15-7-2-8-16(20-15)23-14-6-3-9-19-11-14/h1-11H,(H,20,21,22)
InChIKeyGVYDDJHUGHDTMI-UHFFFAOYSA-N
XLogP4.17
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.76
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-Chloro-4-fluorophenyl)-[4-fluoro-4-[[2-[(3-methoxy-2-pyridinyl)oxy]ethylamino]methyl]piperidin-1-yl]methanone
CID 132256766
N-[6-[2-[[1-(3-chloro-4-fluorobenzoyl)-4-fluoropiperidin-4-yl]methylamino]ethoxy]-2-pyridinyl]acetamide
CID 132256803
(3-Chloro-4-fluorophenyl)-[4-fluoro-4-[[2-[[6-(methylamino)-2-pyridinyl]oxy]ethylamino]methyl]piperidin-1-yl]methanone
CID 132257177
(3-Chloro-4-fluorophenyl)-[4-[[2-[[6-(dimethylamino)-2-pyridinyl]oxy]ethylamino]methyl]-4-fluoropiperidin-1-yl]methanone
CID 138692462
N-(3-hydroxy-2-pyridinyl)-4-phenoxybenzamide
CID 2373623
N-(3-amino-5-pyridin-3-yloxyphenyl)-3-chlorobenzamide
CID 811100
4-[3-(3-Benzyloxy-pyridin-2-yl)-ureido]-benzamide
CID 11574097
3-[3-(3-Benzyloxy-pyridin-2-yl)-ureido]-benzamide
CID 11639129
N-(5-chloropyridin-2-yl)-4-phenoxybenzamide
CID 830775
N-{2-[4-(5-Chloro-pyridin-2-yl)-piperazin-1-yl]-ethyl}-3-methoxy-benzamide
CID 44369020
3-chloro-N-(5-chloropyridin-2-yl)-4-methoxybenzamide
CID 3237952
2-[3-[3-Chloro-5-(4-pyridin-2-ylpiperazine-1-carbonyl)phenoxy]propoxy]guanidine
CID 18322175

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide?
The IUPAC name of 3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide (CID 58349181) is 3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide.
What is the SMILES notation for 3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide?
The canonical SMILES for 3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide is O=C(Nc1cccc(Oc2cccnc2)n1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide?
The InChIKey is GVYDDJHUGHDTMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12ClN3O2/c18-13-5-1-4-12(10-13)17(22)21-15-7-2-8-16(20-15)23-14-6-3-9-19-11-14/h1-11H,(H,20,21,22).
What are the key properties of 3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide?
3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide has a molecular weight of 325.76 g/mol, XLogP of 4.17, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide is sourced from PubChem (CID 58349181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).