2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide

C17H16Cl2N2O2 — CID 71239518

IUPAC2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide
SMILESCc1cc(Cl)cc(Cl)c1CC(=O)NC1CCOc2ncccc21
InChIInChI=1S/C17H16Cl2N2O2/c1-10-7-11(18)8-14(19)13(10)9-16(22)21-15-4-6-23-17-12(15)3-2-5-20-17/h2-3,5,7-8,15H,4,6,9H2,1H3,(H,21,22)
InChIKeyBJKVMKCJNMEKNR-UHFFFAOYSA-N
MW351.23 g/mol
LogP3.88
Rot. Bonds3

About 2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide

2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide (PubChem CID 71239518) has the molecular formula C17H16Cl2N2O2 and a molecular weight of 351.23 g/mol. Its IUPAC name is 2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide
PubChem CID71239518
Molecular FormulaC17H16Cl2N2O2
Molecular Weight351.23 g/mol
Exact Mass350.06
IUPAC Name2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide
SMILESCc1cc(Cl)cc(Cl)c1CC(=O)NC1CCOc2ncccc21
InChIInChI=1S/C17H16Cl2N2O2/c1-10-7-11(18)8-14(19)13(10)9-16(22)21-15-4-6-23-17-12(15)3-2-5-20-17/h2-3,5,7-8,15H,4,6,9H2,1H3,(H,21,22)
InChIKeyBJKVMKCJNMEKNR-UHFFFAOYSA-N
XLogP3.88
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.23
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-c]pyridin-3-yl)acetamide
CID 71239321
N-[(2,4-dichloro-6-methylphenyl)methyl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine-4-carboxamide
CID 78153059
5-(4-chlorophenyl)-N-((2-ethoxypyridin-3-yl)methyl)nicotinamide
CID 52945890
4-chloro-N-[(1R)-1-[4-(2-methoxy-3-pyridinyl)cyclohexyl]propyl]benzamide
CID 164622087
2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
CID 71239153
2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
CID 71239164
2-(4-chlorophenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)propanamide
CID 71239178
2-(2,3-dichlorophenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide
CID 71239185
2-(2-chloro-4-fluorophenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide
CID 71239187
2-(2,4-dichlorophenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
CID 71239193
2-(2,4-dichloro-6-ethylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
CID 71239235
2-(2,4-dichlorophenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)propanamide
CID 71239247

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide?
The IUPAC name of 2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide (CID 71239518) is 2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide.
What is the SMILES notation for 2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide?
The canonical SMILES for 2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide is Cc1cc(Cl)cc(Cl)c1CC(=O)NC1CCOc2ncccc21.
What is the InChIKey of 2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide?
The InChIKey is BJKVMKCJNMEKNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O2/c1-10-7-11(18)8-14(19)13(10)9-16(22)21-15-4-6-23-17-12(15)3-2-5-20-17/h2-3,5,7-8,15H,4,6,9H2,1H3,(H,21,22).
What are the key properties of 2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide?
2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide has a molecular weight of 351.23 g/mol, XLogP of 3.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl)acetamide is sourced from PubChem (CID 71239518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).