2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one

C12H18N2O — CID 110269144

IUPAC2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one
SMILESCc1cc(=O)cc(C2CCCN(C)C2)[nH]1
InChIInChI=1S/C12H18N2O/c1-9-6-11(15)7-12(13-9)10-4-3-5-14(2)8-10/h6-7,10H,3-5,8H2,1-2H3,(H,13,15)
InChIKeyDXCJWFDNSCCFCK-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.49
Rot. Bonds1

About 2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one

2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one (PubChem CID 110269144) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one.

Molecular Properties

Compound Name2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one
PubChem CID110269144
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one
SMILESCc1cc(=O)cc(C2CCCN(C)C2)[nH]1
InChIInChI=1S/C12H18N2O/c1-9-6-11(15)7-12(13-9)10-4-3-5-14(2)8-10/h6-7,10H,3-5,8H2,1-2H3,(H,13,15)
InChIKeyDXCJWFDNSCCFCK-UHFFFAOYSA-N
XLogP1.49
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-6-(1-methylazetidin-3-yl)-1H-pyridin-4-one
CID 95841142
2-[1-(3-methoxybenzoyl)piperidin-3-yl]-6-methyl-1H-pyridin-4-one
CID 110225032
2-methyl-6-pyrrolidin-3-yl-1H-pyridin-4-one
CID 73439726
2-methyl-6-[(3S)-pyrrolidin-3-yl]-1H-pyridin-4-one
CID 92615202
2-[1-(1-ethyl-2-methylbenzimidazole-5-carbonyl)piperidin-3-yl]-6-methyl-1H-pyridin-4-one
CID 110225300
2-methyl-6-[1-(2-propan-2-yl-3H-benzimidazole-5-carbonyl)piperidin-3-yl]-1H-pyridin-4-one
CID 110225304
2-methyl-6-[(2S)-pyrrolidin-2-yl]-1H-pyridin-4-one
CID 56838322
2-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]-6-methyl-1H-pyridin-4-one
CID 110245983
4-[(3R)-1-methylpiperidin-3-yl]benzene-1,2-diol
CID 92966347
1-[5-(1-methylpiperidin-3-yl)-1H-imidazol-2-yl]cyclobutan-1-amine
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1-[5-(1-methylpiperidin-3-yl)-1H-imidazol-2-yl]propan-2-amine
CID 116876745
2-methyl-4-[(3R)-1-methylpiperidin-3-yl]-6-(5-methyl-1H-pyrazol-3-yl)pyrimidine
CID 124942782

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one?
The IUPAC name of 2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one (CID 110269144) is 2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one.
What is the SMILES notation for 2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one?
The canonical SMILES for 2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one is Cc1cc(=O)cc(C2CCCN(C)C2)[nH]1.
What is the InChIKey of 2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one?
The InChIKey is DXCJWFDNSCCFCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9-6-11(15)7-12(13-9)10-4-3-5-14(2)8-10/h6-7,10H,3-5,8H2,1-2H3,(H,13,15).
What are the key properties of 2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one?
2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one has a molecular weight of 206.29 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(1-methylpiperidin-3-yl)-1H-pyridin-4-one is sourced from PubChem (CID 110269144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).