4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one

C13H18N2O3 — CID 114221445

IUPAC4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one
SMILESCOC1CCN(C(=O)c2cc[nH]c(=O)c2)C(C)C1
InChIInChI=1S/C13H18N2O3/c1-9-7-11(18-2)4-6-15(9)13(17)10-3-5-14-12(16)8-10/h3,5,8-9,11H,4,6-7H2,1-2H3,(H,14,16)
InChIKeyHGCOCMDSLDERIH-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.01
Rot. Bonds2

About 4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one

4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one (PubChem CID 114221445) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one
PubChem CID114221445
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one
SMILESCOC1CCN(C(=O)c2cc[nH]c(=O)c2)C(C)C1
InChIInChI=1S/C13H18N2O3/c1-9-7-11(18-2)4-6-15(9)13(17)10-3-5-14-12(16)8-10/h3,5,8-9,11H,4,6-7H2,1-2H3,(H,14,16)
InChIKeyHGCOCMDSLDERIH-UHFFFAOYSA-N
XLogP1.01
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one?
The IUPAC name of 4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one (CID 114221445) is 4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one.
What is the SMILES notation for 4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one?
The canonical SMILES for 4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one is COC1CCN(C(=O)c2cc[nH]c(=O)c2)C(C)C1.
What is the InChIKey of 4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one?
The InChIKey is HGCOCMDSLDERIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-9-7-11(18-2)4-6-15(9)13(17)10-3-5-14-12(16)8-10/h3,5,8-9,11H,4,6-7H2,1-2H3,(H,14,16).
What are the key properties of 4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one?
4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one has a molecular weight of 250.30 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxy-2-methylpiperidine-1-carbonyl)-1H-pyridin-2-one is sourced from PubChem (CID 114221445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).