4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one

C18H21N3O3 — CID 138026932

IUPAC4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCOc1cc(=O)[nH]cc1C(=O)N1CCC(c2ccc(C)nc2)CC1
InChIInChI=1S/C18H21N3O3/c1-12-3-4-14(10-19-12)13-5-7-21(8-6-13)18(23)15-11-20-17(22)9-16(15)24-2/h3-4,9-11,13H,5-8H2,1-2H3,(H,20,22)
InChIKeyLCJFVVKDGWSJFZ-UHFFFAOYSA-N
MW327.38 g/mol
LogP2.11
Rot. Bonds3

About 4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one

4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one (PubChem CID 138026932) has the molecular formula C18H21N3O3 and a molecular weight of 327.38 g/mol. Its IUPAC name is 4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one
PubChem CID138026932
Molecular FormulaC18H21N3O3
Molecular Weight327.38 g/mol
Exact Mass327.16
IUPAC Name4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCOc1cc(=O)[nH]cc1C(=O)N1CCC(c2ccc(C)nc2)CC1
InChIInChI=1S/C18H21N3O3/c1-12-3-4-14(10-19-12)13-5-7-21(8-6-13)18(23)15-11-20-17(22)9-16(15)24-2/h3-4,9-11,13H,5-8H2,1-2H3,(H,20,22)
InChIKeyLCJFVVKDGWSJFZ-UHFFFAOYSA-N
XLogP2.11
TPSA75.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]ethanone
CID 134601157
5-(4-cyclohexylpiperazine-1-carbonyl)-4-methoxy-1H-pyridin-2-one
CID 154784378
4-(6-methyl-3-pyridinyl)piperidine-1-carboxamide
CID 127813854
[4-(4-hydroxyphenyl)piperidin-1-yl]-(2-methoxy-5-methylphenyl)methanone
CID 51327506
5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one
CID 136564527
6-[4-(6-methoxy-3-pyridinyl)piperidine-1-carbonyl]-3-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 166257790
3-methoxy-N-[2-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]-2-oxoethyl]benzamide
CID 136522528
[4-(4-hydroxyphenyl)piperidin-1-yl]-(2-methoxyphenyl)methanone
CID 51327321
5-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]-2-methyl-1H-pyridin-4-one
CID 70778695
(4-chloro-2-methoxyphenyl)-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)piperidin-1-yl]methanone
CID 136579367
1-[4-[2-[1-(3,4-dimethoxybenzoyl)piperidin-4-yl]-6-methylpyridine-3-carbonyl]piperazin-1-yl]ethanone
CID 42867222
[5-(4-fluorophenoxy)-4-methoxy-2-pyridinyl]-[4-(4-methoxy-6-methyl-3-pyridinyl)piperidin-1-yl]methanone
CID 170265048

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one (CID 138026932) is 4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one is COc1cc(=O)[nH]cc1C(=O)N1CCC(c2ccc(C)nc2)CC1.
What is the InChIKey of 4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The InChIKey is LCJFVVKDGWSJFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O3/c1-12-3-4-14(10-19-12)13-5-7-21(8-6-13)18(23)15-11-20-17(22)9-16(15)24-2/h3-4,9-11,13H,5-8H2,1-2H3,(H,20,22).
What are the key properties of 4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one has a molecular weight of 327.38 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 138026932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).