5-chloro-2-methoxy-N-pyridin-4-ylbenzamide

C13H11ClN2O2 — CID 868972

IUPAC5-chloro-2-methoxy-N-pyridin-4-ylbenzamide
SMILESCOc1ccc(Cl)cc1C(=O)Nc1ccncc1
InChIInChI=1S/C13H11ClN2O2/c1-18-12-3-2-9(14)8-11(12)13(17)16-10-4-6-15-7-5-10/h2-8H,1H3,(H,15,16,17)
InChIKeyXNSYDSWTCWLVTM-UHFFFAOYSA-N
MW262.70 g/mol
LogP3.00
Rot. Bonds3

About 5-chloro-2-methoxy-N-pyridin-4-ylbenzamide

5-chloro-2-methoxy-N-pyridin-4-ylbenzamide (PubChem CID 868972) has the molecular formula C13H11ClN2O2 and a molecular weight of 262.70 g/mol. Its IUPAC name is 5-chloro-2-methoxy-N-pyridin-4-ylbenzamide.

Molecular Properties

Compound Name5-chloro-2-methoxy-N-pyridin-4-ylbenzamide
PubChem CID868972
Molecular FormulaC13H11ClN2O2
Molecular Weight262.70 g/mol
Exact Mass262.05
IUPAC Name5-chloro-2-methoxy-N-pyridin-4-ylbenzamide
SMILESCOc1ccc(Cl)cc1C(=O)Nc1ccncc1
InChIInChI=1S/C13H11ClN2O2/c1-18-12-3-2-9(14)8-11(12)13(17)16-10-4-6-15-7-5-10/h2-8H,1H3,(H,15,16,17)
InChIKeyXNSYDSWTCWLVTM-UHFFFAOYSA-N
XLogP3.00
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.70
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-Chlorophenoxy)nicotinamide
CID 2774902
2-methoxy-N-pyridin-4-ylbenzamide
CID 814758
2,6-dimethoxy-N-pyridin-4-ylbenzamide
CID 825634
2-Chloro-N-(4-methoxyphenyl)-3-pyridinecarboxamide
CID 840301
(E)-N-(2-chloropyridin-3-yl)-3-(2-methoxyphenyl)prop-2-enamide
CID 948732
5-chloro-2-methoxy-N-5-quinolinylbenzamide
CID 974232
2-methoxy-N-[3-oxo-3-(pyridin-3-ylamino)propyl]benzamide
CID 2470424
5-chloro-N-(2-chloropyridin-3-yl)-2-methoxybenzamide
CID 3154652
isonicotinic acid (6-chloro-4-oxo-4H-chromen-3-ylmethylene)-hydrazide
CID 9579174
4-(4-chloro-2-methylphenoxy)-N-(pyridin-3-yl)butanamide
CID 654203
N-((2-chloropyridin-3-yl)carbamothioyl)-2-methoxybenzamide
CID 768734
2-methoxy-N-[4-(4-pyridinylmethyl)phenyl]benzamide
CID 776740

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methoxy-N-pyridin-4-ylbenzamide?
The IUPAC name of 5-chloro-2-methoxy-N-pyridin-4-ylbenzamide (CID 868972) is 5-chloro-2-methoxy-N-pyridin-4-ylbenzamide.
What is the SMILES notation for 5-chloro-2-methoxy-N-pyridin-4-ylbenzamide?
The canonical SMILES for 5-chloro-2-methoxy-N-pyridin-4-ylbenzamide is COc1ccc(Cl)cc1C(=O)Nc1ccncc1.
What is the InChIKey of 5-chloro-2-methoxy-N-pyridin-4-ylbenzamide?
The InChIKey is XNSYDSWTCWLVTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O2/c1-18-12-3-2-9(14)8-11(12)13(17)16-10-4-6-15-7-5-10/h2-8H,1H3,(H,15,16,17).
What are the key properties of 5-chloro-2-methoxy-N-pyridin-4-ylbenzamide?
5-chloro-2-methoxy-N-pyridin-4-ylbenzamide has a molecular weight of 262.70 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methoxy-N-pyridin-4-ylbenzamide is sourced from PubChem (CID 868972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).