[2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone

C13H24N2O2 — CID 114826409

IUPAC[2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone
SMILESCC1CC(C(=O)N2C(C)CCCC2CN)CO1
InChIInChI=1S/C13H24N2O2/c1-9-4-3-5-12(7-14)15(9)13(16)11-6-10(2)17-8-11/h9-12H,3-8,14H2,1-2H3
InChIKeySLTVUYNKQCNNKS-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.14
Rot. Bonds2

About [2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone

[2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone (PubChem CID 114826409) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is [2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone.

Molecular Properties

Compound Name[2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone
PubChem CID114826409
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name[2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone
SMILESCC1CC(C(=O)N2C(C)CCCC2CN)CO1
InChIInChI=1S/C13H24N2O2/c1-9-4-3-5-12(7-14)15(9)13(16)11-6-10(2)17-8-11/h9-12H,3-8,14H2,1-2H3
InChIKeySLTVUYNKQCNNKS-UHFFFAOYSA-N
XLogP1.14
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(aminomethyl)piperazin-1-yl]-(5-methyloxolan-3-yl)methanone
CID 114824171
(2,6-dimethylpiperazin-1-yl)-(5-methyloxolan-3-yl)methanone
CID 114826406
1-[2-(aminomethyl)-6-methylpiperidin-1-yl]but-2-yn-1-one
CID 107990412
[2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
CID 107127252
(5-methyloxolan-3-yl)-piperidin-1-ylmethanone
CID 114826120
[4-(1-aminopropan-2-yl)piperazin-1-yl]-(5-methyloxolan-3-yl)methanone
CID 114824162
[2-(aminomethyl)-6-methylpiperidin-1-yl]-(1-methylcyclohexyl)methanone
CID 106828022
cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone
CID 130610084
tert-butyl 3-(aminomethyl)-4-(5-methyloxolane-3-carbonyl)piperazine-1-carboxylate
CID 104979066
[2-(aminomethyl)-6-methylpiperidin-1-yl]-(3-methylimidazol-4-yl)methanone
CID 103511576
1-[2-(aminomethyl)-6-methylpiperidin-1-yl]-2-methoxy-2-methylbutan-1-one
CID 114106030
(4-hydroxy-3-methylpiperidin-1-yl)-(5-methyloxolan-3-yl)methanone
CID 114826278

Frequently Asked Questions

What is the IUPAC name of [2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone?
The IUPAC name of [2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone (CID 114826409) is [2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone.
What is the SMILES notation for [2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone?
The canonical SMILES for [2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone is CC1CC(C(=O)N2C(C)CCCC2CN)CO1.
What is the InChIKey of [2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone?
The InChIKey is SLTVUYNKQCNNKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-9-4-3-5-12(7-14)15(9)13(16)11-6-10(2)17-8-11/h9-12H,3-8,14H2,1-2H3.
What are the key properties of [2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone?
[2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone has a molecular weight of 240.35 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)-6-methylpiperidin-1-yl]-(5-methyloxolan-3-yl)methanone is sourced from PubChem (CID 114826409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).