N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide

C18H22N4O3 — CID 166280430

IUPACN-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide
SMILESCOc1cc(NC(=O)Cc2ccnn2C)ccc1N1CCCCC1=O
InChIInChI=1S/C18H22N4O3/c1-21-14(8-9-19-21)12-17(23)20-13-6-7-15(16(11-13)25-2)22-10-4-3-5-18(22)24/h6-9,11H,3-5,10,12H2,1-2H3,(H,20,23)
InChIKeyGCHKDPYXRJMURQ-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.13
Rot. Bonds5

About N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide

N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide (PubChem CID 166280430) has the molecular formula C18H22N4O3 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide
PubChem CID166280430
Molecular FormulaC18H22N4O3
Molecular Weight342.40 g/mol
Exact Mass342.17
IUPAC NameN-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide
SMILESCOc1cc(NC(=O)Cc2ccnn2C)ccc1N1CCCCC1=O
InChIInChI=1S/C18H22N4O3/c1-21-14(8-9-19-21)12-17(23)20-13-6-7-15(16(11-13)25-2)22-10-4-3-5-18(22)24/h6-9,11H,3-5,10,12H2,1-2H3,(H,20,23)
InChIKeyGCHKDPYXRJMURQ-UHFFFAOYSA-N
XLogP2.13
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(1H-1,2,4-triazol-5-yl)acetamide
CID 166386885
N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-2-(4-phenylphenyl)acetamide
CID 7686701
3-[3-methoxy-4-(2-oxopyrrolidin-1-yl)anilino]-3-oxopropanoic acid
CID 62232072
2-(2,4-dichlorophenoxy)-N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]acetamide
CID 42525030
3-(2,5-dioxopyrrolidin-1-yl)-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]propanamide
CID 55691831
N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]furan-2-carboxamide
CID 7687540
N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
CID 18281436
N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
CID 18140044
N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-3-[(2-phenylacetyl)amino]propanamide
CID 18140046
N-(3,4-dimethylphenyl)-N'-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 30679388
N'-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-N-(4-methoxyphenyl)oxamide
CID 30679370
3,4-diethoxy-N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687515

Frequently Asked Questions

What is the IUPAC name of N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide?
The IUPAC name of N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide (CID 166280430) is N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide.
What is the SMILES notation for N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide?
The canonical SMILES for N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide is COc1cc(NC(=O)Cc2ccnn2C)ccc1N1CCCCC1=O.
What is the InChIKey of N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide?
The InChIKey is GCHKDPYXRJMURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O3/c1-21-14(8-9-19-21)12-17(23)20-13-6-7-15(16(11-13)25-2)22-10-4-3-5-18(22)24/h6-9,11H,3-5,10,12H2,1-2H3,(H,20,23).
What are the key properties of N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide?
N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide has a molecular weight of 342.40 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-(2-methylpyrazol-3-yl)acetamide is sourced from PubChem (CID 166280430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).