N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine

C15H30N2O — CID 83007269

IUPACN-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine
SMILESCC(C)COC1CC(NN2CCCCC2)C1(C)C
InChIInChI=1S/C15H30N2O/c1-12(2)11-18-14-10-13(15(14,3)4)16-17-8-6-5-7-9-17/h12-14,16H,5-11H2,1-4H3
InChIKeyMSXLMLBGZNRVNS-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.82
Rot. Bonds5

About N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine

N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine (PubChem CID 83007269) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine.

Molecular Properties

Compound NameN-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine
PubChem CID83007269
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine
SMILESCC(C)COC1CC(NN2CCCCC2)C1(C)C
InChIInChI=1S/C15H30N2O/c1-12(2)11-18-14-10-13(15(14,3)4)16-17-8-6-5-7-9-17/h12-14,16H,5-11H2,1-4H3
InChIKeyMSXLMLBGZNRVNS-UHFFFAOYSA-N
XLogP2.82
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine?
The IUPAC name of N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine (CID 83007269) is N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine.
What is the SMILES notation for N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine?
The canonical SMILES for N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine is CC(C)COC1CC(NN2CCCCC2)C1(C)C.
What is the InChIKey of N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine?
The InChIKey is MSXLMLBGZNRVNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-12(2)11-18-14-10-13(15(14,3)4)16-17-8-6-5-7-9-17/h12-14,16H,5-11H2,1-4H3.
What are the key properties of N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine?
N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine has a molecular weight of 254.42 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]piperidin-1-amine is sourced from PubChem (CID 83007269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).