N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine

C11H21NO2 — CID 66352903

IUPACN,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine
SMILESCNC1CC(OC2CCOC2)C1(C)C
InChIInChI=1S/C11H21NO2/c1-11(2)9(12-3)6-10(11)14-8-4-5-13-7-8/h8-10,12H,4-7H2,1-3H3
InChIKeyFMFLTKDSRWSTDB-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.18
Rot. Bonds3

About N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine

N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine (PubChem CID 66352903) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine
PubChem CID66352903
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine
SMILESCNC1CC(OC2CCOC2)C1(C)C
InChIInChI=1S/C11H21NO2/c1-11(2)9(12-3)6-10(11)14-8-4-5-13-7-8/h8-10,12H,4-7H2,1-3H3
InChIKeyFMFLTKDSRWSTDB-UHFFFAOYSA-N
XLogP1.18
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine?
The IUPAC name of N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine (CID 66352903) is N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine?
The canonical SMILES for N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine is CNC1CC(OC2CCOC2)C1(C)C.
What is the InChIKey of N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine?
The InChIKey is FMFLTKDSRWSTDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-11(2)9(12-3)6-10(11)14-8-4-5-13-7-8/h8-10,12H,4-7H2,1-3H3.
What are the key properties of N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine?
N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine has a molecular weight of 199.29 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine is sourced from PubChem (CID 66352903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).