[2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone

C16H30N2O — CID 106828027

IUPAC[2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone
SMILESCNCCC1CCCCN1C(=O)C1(C)CCCCC1
InChIInChI=1S/C16H30N2O/c1-16(10-5-3-6-11-16)15(19)18-13-7-4-8-14(18)9-12-17-2/h14,17H,3-13H2,1-2H3
InChIKeyAUMIGUVURUCJCM-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.95
Rot. Bonds4

About [2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone

[2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone (PubChem CID 106828027) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is [2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone.

Molecular Properties

Compound Name[2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone
PubChem CID106828027
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name[2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone
SMILESCNCCC1CCCCN1C(=O)C1(C)CCCCC1
InChIInChI=1S/C16H30N2O/c1-16(10-5-3-6-11-16)15(19)18-13-7-4-8-14(18)9-12-17-2/h14,17H,3-13H2,1-2H3
InChIKeyAUMIGUVURUCJCM-UHFFFAOYSA-N
XLogP2.95
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(chloromethyl)piperidin-1-yl]-(1-methylcyclohexyl)methanone
CID 106828939
(2,2-dimethylcyclohexyl)-[2-[2-(methylamino)ethyl]piperidin-1-yl]methanone
CID 107180809
cyclooctyl-[2-[2-(methylamino)ethyl]piperidin-1-yl]methanone
CID 65023261
methyl 2-[1-(1-methylcyclohexanecarbonyl)piperidin-2-yl]acetate
CID 106828161
[2-(2-hydroxyethyl)pyrrolidin-1-yl]-(3-methylpiperidin-3-yl)methanone
CID 112748638
1-[[2-[2-(methylamino)ethyl]piperidin-1-yl]methyl]cyclohexan-1-ol
CID 65213774
1-(2-propylpiperidine-1-carbonyl)cyclohexane-1-carbonitrile
CID 83056317
1-[2-[2-(methylamino)ethyl]piperidin-1-yl]-2-(oxolan-2-yl)ethanone
CID 65160147
[2-[2-(methylamino)ethyl]piperidin-1-yl]-(2,4,6-trifluorophenyl)methanone
CID 65100880
[2-[2-(methylamino)ethyl]piperidin-1-yl]-pyridazin-4-ylmethanone
CID 113439400
[2-[2-(methylamino)ethyl]piperidin-1-yl]-(4-methylsulfanylphenyl)methanone
CID 79217054
1-[(2R)-2-(methylaminomethyl)piperidin-1-yl]ethanone
CID 95037259

Frequently Asked Questions

What is the IUPAC name of [2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone?
The IUPAC name of [2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone (CID 106828027) is [2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone.
What is the SMILES notation for [2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone?
The canonical SMILES for [2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone is CNCCC1CCCCN1C(=O)C1(C)CCCCC1.
What is the InChIKey of [2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone?
The InChIKey is AUMIGUVURUCJCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-16(10-5-3-6-11-16)15(19)18-13-7-4-8-14(18)9-12-17-2/h14,17H,3-13H2,1-2H3.
What are the key properties of [2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone?
[2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone has a molecular weight of 266.43 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(methylamino)ethyl]piperidin-1-yl]-(1-methylcyclohexyl)methanone is sourced from PubChem (CID 106828027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).