1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide

C18H20N2O4 — CID 97465078

IUPAC1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide
SMILESCOc1ccc(-n2cc(C(=O)NC[C@H]3CCCO3)ccc2=O)cc1
InChIInChI=1S/C18H20N2O4/c1-23-15-7-5-14(6-8-15)20-12-13(4-9-17(20)21)18(22)19-11-16-3-2-10-24-16/h4-9,12,16H,2-3,10-11H2,1H3,(H,19,22)/t16-/m1/s1
InChIKeyZWVYXQLXPAGWNH-MRXNPFEDSA-N
MW328.37 g/mol
LogP1.75
Rot. Bonds5

About 1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide

1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide (PubChem CID 97465078) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide
PubChem CID97465078
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC Name1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide
SMILESCOc1ccc(-n2cc(C(=O)NC[C@H]3CCCO3)ccc2=O)cc1
InChIInChI=1S/C18H20N2O4/c1-23-15-7-5-14(6-8-15)20-12-13(4-9-17(20)21)18(22)19-11-16-3-2-10-24-16/h4-9,12,16H,2-3,10-11H2,1H3,(H,19,22)/t16-/m1/s1
InChIKeyZWVYXQLXPAGWNH-MRXNPFEDSA-N
XLogP1.75
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-methoxyphenyl)-6-oxo-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 91945572
4-N-[(4-methoxyphenyl)methyl]-1-N-(oxolan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 109045580
methyl 2-[[1-(4-methoxyphenyl)-6-oxopyridine-3-carbonyl]amino]acetate
CID 91945548
N-cyclohexyl-1-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide
CID 91945533
6-methoxy-1-(4-methoxyphenyl)-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridazine-3-carboxamide
CID 95099143
4-methoxy-N-[[(2S)-oxolan-2-yl]methylcarbamothioyl]benzamide
CID 806255
1-(4-methoxyphenyl)-3,5-dimethyl-N-(oxolan-2-ylmethyl)pyrazole-4-carboxamide
CID 83285028
4-ethyl-2-(4-methoxyphenyl)-3,5-dioxo-N-(oxolan-2-ylmethyl)-1,2,4-triazine-6-carboxamide
CID 42836032
3-methoxy-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 669434
5-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 109184994
4-ethoxy-N-(oxolan-2-ylmethyl)benzamide
CID 2850672
1-(4-methoxyphenyl)-6-oxo-N-pentan-2-ylpyridine-3-carboxamide
CID 91955057

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide?
The IUPAC name of 1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide (CID 97465078) is 1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide.
What is the SMILES notation for 1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide?
The canonical SMILES for 1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide is COc1ccc(-n2cc(C(=O)NC[C@H]3CCCO3)ccc2=O)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide?
The InChIKey is ZWVYXQLXPAGWNH-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-23-15-7-5-14(6-8-15)20-12-13(4-9-17(20)21)18(22)19-11-16-3-2-10-24-16/h4-9,12,16H,2-3,10-11H2,1H3,(H,19,22)/t16-/m1/s1.
What are the key properties of 1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide?
1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide has a molecular weight of 328.37 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-6-oxo-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide is sourced from PubChem (CID 97465078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).