(1-methylpiperidin-3-yl)-piperidin-2-ylmethanone

C12H22N2O — CID 116916943

IUPAC(1-methylpiperidin-3-yl)-piperidin-2-ylmethanone
SMILESCN1CCCC(C(=O)C2CCCCN2)C1
InChIInChI=1S/C12H22N2O/c1-14-8-4-5-10(9-14)12(15)11-6-2-3-7-13-11/h10-11,13H,2-9H2,1H3
InChIKeyAIZNBVBIUPCCSG-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.04
Rot. Bonds2

About (1-methylpiperidin-3-yl)-piperidin-2-ylmethanone

(1-methylpiperidin-3-yl)-piperidin-2-ylmethanone (PubChem CID 116916943) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is (1-methylpiperidin-3-yl)-piperidin-2-ylmethanone.

Molecular Properties

Compound Name(1-methylpiperidin-3-yl)-piperidin-2-ylmethanone
PubChem CID116916943
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name(1-methylpiperidin-3-yl)-piperidin-2-ylmethanone
SMILESCN1CCCC(C(=O)C2CCCCN2)C1
InChIInChI=1S/C12H22N2O/c1-14-8-4-5-10(9-14)12(15)11-6-2-3-7-13-11/h10-11,13H,2-9H2,1H3
InChIKeyAIZNBVBIUPCCSG-UHFFFAOYSA-N
XLogP1.04
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide
CID 104913856
bis[(2S)-piperidin-2-yl]methanone
CID 174971247
N-methyl-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
CID 62546250
(3S)-1-methylpiperidine-3-carboxylic acid;hydrochloride
CID 67923100
1-methylpiperidine-3-carbothioic S-acid
CID 116918903
1-methylpiperidine-3-carboxylic acid;hydrochloride
CID 12514711
[(3S)-oxan-3-yl]-[(2R)-piperidin-2-yl]methanone
CID 124675210
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]piperidine-2-carboxamide
CID 55174038
(3,4-dimethylpiperazin-1-yl)-[(2S)-piperidin-2-yl]methanone
CID 104913945
(1-methylpyrrolidin-3-yl)-piperidin-3-ylmethanone
CID 116916955
pyrrolidin-2-yl-[(2R)-pyrrolidin-2-yl]methanone
CID 20598954
N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride
CID 119783429

Frequently Asked Questions

What is the IUPAC name of (1-methylpiperidin-3-yl)-piperidin-2-ylmethanone?
The IUPAC name of (1-methylpiperidin-3-yl)-piperidin-2-ylmethanone (CID 116916943) is (1-methylpiperidin-3-yl)-piperidin-2-ylmethanone.
What is the SMILES notation for (1-methylpiperidin-3-yl)-piperidin-2-ylmethanone?
The canonical SMILES for (1-methylpiperidin-3-yl)-piperidin-2-ylmethanone is CN1CCCC(C(=O)C2CCCCN2)C1.
What is the InChIKey of (1-methylpiperidin-3-yl)-piperidin-2-ylmethanone?
The InChIKey is AIZNBVBIUPCCSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-14-8-4-5-10(9-14)12(15)11-6-2-3-7-13-11/h10-11,13H,2-9H2,1H3.
What are the key properties of (1-methylpiperidin-3-yl)-piperidin-2-ylmethanone?
(1-methylpiperidin-3-yl)-piperidin-2-ylmethanone has a molecular weight of 210.32 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpiperidin-3-yl)-piperidin-2-ylmethanone is sourced from PubChem (CID 116916943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).