6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one

C13H19N3O2 — CID 114040275

IUPAC6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCC1CCCC(CN)N1C(=O)c1cccc(=O)[nH]1
InChIInChI=1S/C13H19N3O2/c1-9-4-2-5-10(8-14)16(9)13(18)11-6-3-7-12(17)15-11/h3,6-7,9-10H,2,4-5,8,14H2,1H3,(H,15,17)
InChIKeyDKSGVCLPERBKPT-UHFFFAOYSA-N
MW249.31 g/mol
LogP0.72
Rot. Bonds2

About 6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one

6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one (PubChem CID 114040275) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one
PubChem CID114040275
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCC1CCCC(CN)N1C(=O)c1cccc(=O)[nH]1
InChIInChI=1S/C13H19N3O2/c1-9-4-2-5-10(8-14)16(9)13(18)11-6-3-7-12(17)15-11/h3,6-7,9-10H,2,4-5,8,14H2,1H3,(H,15,17)
InChIKeyDKSGVCLPERBKPT-UHFFFAOYSA-N
XLogP0.72
TPSA79.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(2S,6R)-2,6-dimethylpiperidine-1-carbonyl]-1H-pyridin-2-one
CID 114040424
6-[2-(2-aminoethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 113322539
[2-(aminomethyl)-6-methylpiperidin-1-yl]-(1-methylindazol-3-yl)methanone
CID 103120794
6-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 114040292
[2-(aminomethyl)-6-methylpiperidin-1-yl]-(2-chloro-4-methylphenyl)methanone
CID 106862177
[2-(aminomethyl)-6-methylpiperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 103120796
[2-(aminomethyl)-6-methylpiperidin-1-yl]-(3-methylimidazol-4-yl)methanone
CID 103511576
6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 107261752
[2-(aminomethyl)-6-methylpiperidin-1-yl]-(4,5-dibromothiophen-2-yl)methanone
CID 80537943
[2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
CID 107127252
[2-(aminomethyl)-6-methylpiperidin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
CID 102884019
6-[2-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-1-carbonyl]-1H-pyridin-2-one
CID 91793447

Frequently Asked Questions

What is the IUPAC name of 6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one (CID 114040275) is 6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one is CC1CCCC(CN)N1C(=O)c1cccc(=O)[nH]1.
What is the InChIKey of 6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one?
The InChIKey is DKSGVCLPERBKPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-9-4-2-5-10(8-14)16(9)13(18)11-6-3-7-12(17)15-11/h3,6-7,9-10H,2,4-5,8,14H2,1H3,(H,15,17).
What are the key properties of 6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one?
6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one has a molecular weight of 249.31 g/mol, XLogP of 0.72, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(aminomethyl)-6-methylpiperidine-1-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 114040275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).