2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine

C14H28N2O — CID 81171118

IUPAC2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine
SMILESCN(CCC1(CN)CCC1)CC1CCCCO1
InChIInChI=1S/C14H28N2O/c1-16(11-13-5-2-3-10-17-13)9-8-14(12-15)6-4-7-14/h13H,2-12,15H2,1H3
InChIKeyMOBIXPURNNZRJL-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.01
Rot. Bonds6

About 2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine

2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine (PubChem CID 81171118) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine
PubChem CID81171118
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine
SMILESCN(CCC1(CN)CCC1)CC1CCCCO1
InChIInChI=1S/C14H28N2O/c1-16(11-13-5-2-3-10-17-13)9-8-14(12-15)6-4-7-14/h13H,2-12,15H2,1H3
InChIKeyMOBIXPURNNZRJL-UHFFFAOYSA-N
XLogP2.01
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(aminomethyl)cyclopentyl]methyl]-N-methyl-1-(oxan-2-yl)methanamine
CID 62257278
2-[1-(aminomethyl)cyclobutyl]-N-(cyclobutylmethyl)-N-methylethanamine
CID 81171568
1-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclobutan-1-amine
CID 79844694
1-(aminomethyl)-2-[2-[methyl(oxan-2-ylmethyl)amino]ethyl]cyclopentan-1-ol
CID 79587854
1-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentan-1-amine
CID 64679700
N-methyl-N-(oxan-2-ylmethyl)propan-1-amine
CID 169307436
N-methyl-N-(oxepan-2-ylmethyl)propan-1-amine
CID 169307437
2-chloro-N-methyl-N-(oxolan-2-ylmethyl)ethanamine
CID 61436036
3-[methyl(oxan-2-ylmethyl)amino]propanenitrile
CID 43403608
1-[[methyl(oxan-2-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 61436218
N,N'-dimethyl-N'-(oxan-2-ylmethyl)butane-1,4-diamine
CID 61436273
N-methyl-N-[[1-(methylaminomethyl)cyclopentyl]methyl]-1-(oxan-2-yl)methanamine
CID 62256760

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine?
The IUPAC name of 2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine (CID 81171118) is 2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine.
What is the SMILES notation for 2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine?
The canonical SMILES for 2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine is CN(CCC1(CN)CCC1)CC1CCCCO1.
What is the InChIKey of 2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine?
The InChIKey is MOBIXPURNNZRJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-16(11-13-5-2-3-10-17-13)9-8-14(12-15)6-4-7-14/h13H,2-12,15H2,1H3.
What are the key properties of 2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine?
2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine has a molecular weight of 240.39 g/mol, XLogP of 2.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-(oxan-2-ylmethyl)ethanamine is sourced from PubChem (CID 81171118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).