3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide

C14H13ClN2O2 — CID 34958850

IUPAC3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide
SMILESCCOc1ncccc1NC(=O)c1cccc(Cl)c1
InChIInChI=1S/C14H13ClN2O2/c1-2-19-14-12(7-4-8-16-14)17-13(18)10-5-3-6-11(15)9-10/h3-9H,2H2,1H3,(H,17,18)
InChIKeyYAGYCILQNJACPR-UHFFFAOYSA-N
MW276.72 g/mol
LogP3.39
Rot. Bonds4

About 3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide

3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide (PubChem CID 34958850) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is 3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide.

Molecular Properties

Compound Name3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide
PubChem CID34958850
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC Name3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide
SMILESCCOc1ncccc1NC(=O)c1cccc(Cl)c1
InChIInChI=1S/C14H13ClN2O2/c1-2-19-14-12(7-4-8-16-14)17-13(18)10-5-3-6-11(15)9-10/h3-9H,2H2,1H3,(H,17,18)
InChIKeyYAGYCILQNJACPR-UHFFFAOYSA-N
XLogP3.39
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethoxy-3-pyridinyl)-5-hydroxypyridine-3-carboxamide
CID 63859607
N-(2-ethoxy-3-pyridinyl)thiophene-3-carboxamide
CID 34879256
5-bromo-2-chloro-N-(2-ethoxy-3-pyridinyl)benzamide
CID 34958257
3-chloro-N-quinolin-5-ylbenzamide
CID 5127132
N-(5-acetyl-2-ethoxyphenyl)-3-chlorobenzamide
CID 94763103
6-(dimethylamino)-N-(2-ethoxy-3-pyridinyl)pyridine-3-carboxamide
CID 34955483
3-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide
CID 17134086
N-(2-ethoxy-3-pyridinyl)-3-methoxy-4-phenylmethoxybenzamide
CID 34876331
3-chloro-N-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)benzamide
CID 122355868
2-(2-bromo-4-chlorophenoxy)-N-(2-ethoxy-3-pyridinyl)acetamide
CID 34877130
3-fluoro-N-(2-methoxy-3-pyridinyl)benzamide
CID 47038518
2,5-dibromo-N-(2-ethoxy-3-pyridinyl)benzamide
CID 114371185

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide?
The IUPAC name of 3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide (CID 34958850) is 3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide.
What is the SMILES notation for 3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide?
The canonical SMILES for 3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide is CCOc1ncccc1NC(=O)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide?
The InChIKey is YAGYCILQNJACPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c1-2-19-14-12(7-4-8-16-14)17-13(18)10-5-3-6-11(15)9-10/h3-9H,2H2,1H3,(H,17,18).
What are the key properties of 3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide?
3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide has a molecular weight of 276.72 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-ethoxy-3-pyridinyl)benzamide is sourced from PubChem (CID 34958850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).