N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine

C15H30N2O — CID 80998456

IUPACN-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1CCC1N1CCOCC1(C)C
InChIInChI=1S/C15H30N2O/c1-14(2,3)16-10-12-6-7-13(12)17-8-9-18-11-15(17,4)5/h12-13,16H,6-11H2,1-5H3
InChIKeyDUZDKZLWXHKORF-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.26
Rot. Bonds3

About N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine

N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine (PubChem CID 80998456) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine
PubChem CID80998456
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1CCC1N1CCOCC1(C)C
InChIInChI=1S/C15H30N2O/c1-14(2,3)16-10-12-6-7-13(12)17-8-9-18-11-15(17,4)5/h12-13,16H,6-11H2,1-5H3
InChIKeyDUZDKZLWXHKORF-UHFFFAOYSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine (CID 80998456) is N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine is CC(C)(C)NCC1CCC1N1CCOCC1(C)C.
What is the InChIKey of N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine?
The InChIKey is DUZDKZLWXHKORF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-14(2,3)16-10-12-6-7-13(12)17-8-9-18-11-15(17,4)5/h12-13,16H,6-11H2,1-5H3.
What are the key properties of N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine?
N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine has a molecular weight of 254.42 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(3,3-dimethylmorpholin-4-yl)cyclobutyl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 80998456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).