N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide

C15H15ClN2O2 — CID 17099005

IUPACN-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)Nc2cccnc2Cl)c1C
InChIInChI=1S/C15H15ClN2O2/c1-10-5-3-7-13(11(10)2)20-9-14(19)18-12-6-4-8-17-15(12)16/h3-8H,9H2,1-2H3,(H,18,19)
InChIKeyPKRDROMOYICYCL-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.37
Rot. Bonds4

About N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide

N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide (PubChem CID 17099005) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide
PubChem CID17099005
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC NameN-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)Nc2cccnc2Cl)c1C
InChIInChI=1S/C15H15ClN2O2/c1-10-5-3-7-13(11(10)2)20-9-14(19)18-12-6-4-8-17-15(12)16/h3-8H,9H2,1-2H3,(H,18,19)
InChIKeyPKRDROMOYICYCL-UHFFFAOYSA-N
XLogP3.37
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-(4-chloro-3,5-dimethylphenoxy)-N-(2-chloro-3-pyridinyl)acetamide
CID 934072
N-(2,3-dimethylphenyl)-2-quinolin-8-yloxyacetamide
CID 94221258
N-(2-chloro-3-pyridinyl)-2-(4-methylphenoxy)acetamide
CID 823681
2-(2,3-dimethylphenoxy)-N-naphthalen-1-ylacetamide
CID 720683
2-(2,3-dimethylphenoxy)-N-(2-fluorophenyl)acetamide
CID 720662
N-(5-chloro-2-fluorophenyl)-2-(2,3-dimethylphenoxy)acetamide
CID 8759085
[2-[(2-chloro-3-pyridinyl)amino]-2-oxoethyl]-[2-(2,3-dimethylanilino)-2-oxoethyl]-methylazanium
CID 8710007
N-(2-chloro-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide
CID 18075657
3-amino-N-[2-[[2-(2,3-dimethylphenoxy)acetyl]amino]phenyl]propanamide
CID 82034375
N-(4-amino-2-chlorophenyl)-2-(2,3-dimethylphenoxy)acetamide
CID 28867352
[2-(3-chloro-2-methylanilino)-2-oxoethyl] 2-(2,3-dimethylphenoxy)acetate
CID 7982074
2-(2,3-dimethylphenoxy)-N-(2,5-dimethylphenyl)acetamide
CID 720593

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide?
The IUPAC name of N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide (CID 17099005) is N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide?
The canonical SMILES for N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide is Cc1cccc(OCC(=O)Nc2cccnc2Cl)c1C.
What is the InChIKey of N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide?
The InChIKey is PKRDROMOYICYCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10-5-3-7-13(11(10)2)20-9-14(19)18-12-6-4-8-17-15(12)16/h3-8H,9H2,1-2H3,(H,18,19).
What are the key properties of N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide?
N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide has a molecular weight of 290.75 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-3-pyridinyl)-2-(2,3-dimethylphenoxy)acetamide is sourced from PubChem (CID 17099005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).