N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine

C13H26N2 — CID 81000100

IUPACN-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine
SMILESCCNCC1CCC1N1CCCCC1C
InChIInChI=1S/C13H26N2/c1-3-14-10-12-7-8-13(12)15-9-5-4-6-11(15)2/h11-14H,3-10H2,1-2H3
InChIKeyPOFDBPJWQNZUHE-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.25
Rot. Bonds4

About N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine

N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine (PubChem CID 81000100) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine
PubChem CID81000100
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine
SMILESCCNCC1CCC1N1CCCCC1C
InChIInChI=1S/C13H26N2/c1-3-14-10-12-7-8-13(12)15-9-5-4-6-11(15)2/h11-14H,3-10H2,1-2H3
InChIKeyPOFDBPJWQNZUHE-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(2-methylpyrrolidin-1-yl)cyclobutyl]methyl]ethanamine
CID 80998653
N-[[2-(2-ethylazepan-1-yl)cyclobutyl]methyl]ethanamine
CID 104692327
N-[[2-(2-methylazepan-1-yl)cyclobutyl]methyl]propan-2-amine
CID 81005662
N-[[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]ethanamine
CID 66523440
N-[[2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)cyclobutyl]methyl]ethanamine
CID 81004630
N-[[2-(2-propylpiperidin-1-yl)cyclobutyl]methyl]propan-1-amine
CID 83061780
N-[[2-(2,3-dimethylpiperidin-1-yl)cyclobutyl]methyl]propan-1-amine
CID 80996996
N-ethyl-2-(2-methylpyrrolidin-1-yl)cyclododecan-1-amine
CID 63469025
N-[[2-(2-methylmorpholin-4-yl)cyclobutyl]methyl]ethanamine
CID 80998341
[4-ethyl-2-(2-methylpiperidin-1-yl)cyclohexyl]methanamine
CID 43293344
N-[[2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)cyclobutyl]methyl]propan-1-amine
CID 82753410
N-[[1-(3,5-dimethylcyclohexyl)piperidin-2-yl]methyl]ethanamine
CID 64730948

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine?
The IUPAC name of N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine (CID 81000100) is N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine?
The canonical SMILES for N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine is CCNCC1CCC1N1CCCCC1C.
What is the InChIKey of N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine?
The InChIKey is POFDBPJWQNZUHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-3-14-10-12-7-8-13(12)15-9-5-4-6-11(15)2/h11-14H,3-10H2,1-2H3.
What are the key properties of N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine?
N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine has a molecular weight of 210.36 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2-methylpiperidin-1-yl)cyclobutyl]methyl]ethanamine is sourced from PubChem (CID 81000100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).