N-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide

C14H12Cl2N2O2 — CID 1483036

IUPACN-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O
InChIInChI=1S/C14H12Cl2N2O2/c1-9(19)17-13-3-2-6-18(14(13)20)8-10-4-5-11(15)12(16)7-10/h2-7H,8H2,1H3,(H,17,19)
InChIKeyOIAQSMVXEHPLNL-UHFFFAOYSA-N
MW311.17 g/mol
LogP3.16
Rot. Bonds3

About N-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide

N-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide (PubChem CID 1483036) has the molecular formula C14H12Cl2N2O2 and a molecular weight of 311.17 g/mol. Its IUPAC name is N-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide
PubChem CID1483036
Molecular FormulaC14H12Cl2N2O2
Molecular Weight311.17 g/mol
Exact Mass310.03
IUPAC NameN-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O
InChIInChI=1S/C14H12Cl2N2O2/c1-9(19)17-13-3-2-6-18(14(13)20)8-10-4-5-11(15)12(16)7-10/h2-7H,8H2,1H3,(H,17,19)
InChIKeyOIAQSMVXEHPLNL-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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Related Compounds

N'-acetyl-1-[(3,4-dichlorophenyl)methyl]-2-oxopyridine-3-carbohydrazide
CID 30837067
1-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-prop-2-enylthiourea
CID 3783826
1-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-[3-(trifluoromethyl)phenyl]urea
CID 1478530
1-[(3,4-dichlorophenyl)methyl]-N'-hydroxy-2-oxopyridine-3-carboximidamide
CID 107018071
N-[(4-acetamidophenyl)methyl]-N'-[1-[(4-methylphenyl)methyl]-2-oxo-3-pyridinyl]oxamide
CID 167814290
2-(3-acetamido-2-oxo-1-pyridinyl)acetic acid
CID 11820421
N-(4-acetamidophenyl)-1-[(3-chlorophenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7599167
1-[(3-chlorophenyl)methyl]-N-(3,4-dichlorophenyl)-2-oxopyridine-3-carboxamide
CID 8670922
N-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methyl]-2-methylpropan-2-amine
CID 66401437
2-tert-butylsulfanyl-N-[1-[(4-fluorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide
CID 71921798
N-[1-[(4-methylphenyl)methyl]-2-oxo-3-pyridinyl]pyrazine-2-carboxamide
CID 71910292
N-(1-benzyl-2-oxo-3-pyridinyl)-2-(4-methoxyphenyl)acetamide
CID 71921771

Frequently Asked Questions

What is the IUPAC name of N-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide?
The IUPAC name of N-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide (CID 1483036) is N-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide.
What is the SMILES notation for N-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide?
The canonical SMILES for N-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide is CC(=O)Nc1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O.
What is the InChIKey of N-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide?
The InChIKey is OIAQSMVXEHPLNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O2/c1-9(19)17-13-3-2-6-18(14(13)20)8-10-4-5-11(15)12(16)7-10/h2-7H,8H2,1H3,(H,17,19).
What are the key properties of N-[1-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide?
N-[1-[(3,4-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-[(3,4-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]acetamide is sourced from PubChem (CID 1483036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).