N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide

C14H12Cl2N2O2 — CID 3828707

IUPACN-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cccn(Cc2c(Cl)cccc2Cl)c1=O
InChIInChI=1S/C14H12Cl2N2O2/c1-9(19)17-13-6-3-7-18(14(13)20)8-10-11(15)4-2-5-12(10)16/h2-7H,8H2,1H3,(H,17,19)
InChIKeyKWEYNWDEWJCLQU-UHFFFAOYSA-N
MW311.17 g/mol
LogP3.16
Rot. Bonds3

About N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide

N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide (PubChem CID 3828707) has the molecular formula C14H12Cl2N2O2 and a molecular weight of 311.17 g/mol. Its IUPAC name is N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide
PubChem CID3828707
Molecular FormulaC14H12Cl2N2O2
Molecular Weight311.17 g/mol
Exact Mass310.03
IUPAC NameN-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cccn(Cc2c(Cl)cccc2Cl)c1=O
InChIInChI=1S/C14H12Cl2N2O2/c1-9(19)17-13-6-3-7-18(14(13)20)8-10-11(15)4-2-5-12(10)16/h2-7H,8H2,1H3,(H,17,19)
InChIKeyKWEYNWDEWJCLQU-UHFFFAOYSA-N
XLogP3.16
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.17
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide?
The IUPAC name of N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide (CID 3828707) is N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide.
What is the SMILES notation for N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide?
The canonical SMILES for N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide is CC(=O)Nc1cccn(Cc2c(Cl)cccc2Cl)c1=O.
What is the InChIKey of N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide?
The InChIKey is KWEYNWDEWJCLQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O2/c1-9(19)17-13-6-3-7-18(14(13)20)8-10-11(15)4-2-5-12(10)16/h2-7H,8H2,1H3,(H,17,19).
What are the key properties of N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide?
N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide has a molecular weight of 311.17 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide is sourced from PubChem (CID 3828707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).