2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide

C15H15ClN2O3 — CID 110730520

IUPAC2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide
SMILESCn1cc(CNC(=O)COc2ccc(Cl)cc2)ccc1=O
InChIInChI=1S/C15H15ClN2O3/c1-18-9-11(2-7-15(18)20)8-17-14(19)10-21-13-5-3-12(16)4-6-13/h2-7,9H,8,10H2,1H3,(H,17,19)
InChIKeyVIZOAPRNCFUPSS-UHFFFAOYSA-N
MW306.75 g/mol
LogP1.73
Rot. Bonds5

About 2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide

2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide (PubChem CID 110730520) has the molecular formula C15H15ClN2O3 and a molecular weight of 306.75 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide
PubChem CID110730520
Molecular FormulaC15H15ClN2O3
Molecular Weight306.75 g/mol
Exact Mass306.08
IUPAC Name2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide
SMILESCn1cc(CNC(=O)COc2ccc(Cl)cc2)ccc1=O
InChIInChI=1S/C15H15ClN2O3/c1-18-9-11(2-7-15(18)20)8-17-14(19)10-21-13-5-3-12(16)4-6-13/h2-7,9H,8,10H2,1H3,(H,17,19)
InChIKeyVIZOAPRNCFUPSS-UHFFFAOYSA-N
XLogP1.73
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide
CID 809048
2-(4-chlorophenoxy)-N-[[4-(methylaminomethyl)phenyl]methyl]acetamide
CID 170046008
2-(3-fluorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide
CID 110730575
2-[[2-(4-chlorophenoxy)acetyl]amino]-N-[(4-chlorophenyl)methyl]acetamide
CID 110285271
4-[[[2-(4-chlorophenoxy)acetyl]amino]methyl]benzoic acid
CID 17171925
2-(4-chlorophenoxy)-N-[[6-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]acetamide
CID 122274351
2-(4-chlorophenoxy)-N-[[4-(difluoromethoxy)phenyl]methyl]acetamide
CID 42007084
2-(4-chlorophenoxy)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]acetamide
CID 8544780
2-(4-chlorophenoxy)-N-[[4-(dimethylsulfamoyl)phenyl]methyl]acetamide
CID 30125973
2-(4-chlorophenoxy)-N-[(1-methylpyrazol-3-yl)methyl]acetamide
CID 19329147
2-(4-chlorophenoxy)-N-[2-(1-methylpyrrol-3-yl)ethyl]acetamide
CID 110789180
N-[(4-chlorophenyl)methyl]-2-[4-[methyl(propan-2-ylcarbamoyl)amino]phenoxy]acetamide
CID 55864990

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide (CID 110730520) is 2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide is Cn1cc(CNC(=O)COc2ccc(Cl)cc2)ccc1=O.
What is the InChIKey of 2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide?
The InChIKey is VIZOAPRNCFUPSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O3/c1-18-9-11(2-7-15(18)20)8-17-14(19)10-21-13-5-3-12(16)4-6-13/h2-7,9H,8,10H2,1H3,(H,17,19).
What are the key properties of 2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide?
2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide has a molecular weight of 306.75 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-[(1-methyl-6-oxo-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 110730520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).