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

C14H27NO2 — CID 66350491

IUPACN,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine
SMILESCCNC1CC(OC2CCOC2)C1(CC)CC
InChIInChI=1S/C14H27NO2/c1-4-14(5-2)12(15-6-3)9-13(14)17-11-7-8-16-10-11/h11-13,15H,4-10H2,1-3H3
InChIKeyWBSHYLCTJYGGOY-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.35
Rot. Bonds6

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

N,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine (PubChem CID 66350491) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine.

Molecular Properties

Compound NameN,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine
PubChem CID66350491
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine
SMILESCCNC1CC(OC2CCOC2)C1(CC)CC
InChIInChI=1S/C14H27NO2/c1-4-14(5-2)12(15-6-3)9-13(14)17-11-7-8-16-10-11/h11-13,15H,4-10H2,1-3H3
InChIKeyWBSHYLCTJYGGOY-UHFFFAOYSA-N
XLogP2.35
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine?
The IUPAC name of N,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine (CID 66350491) is N,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine.
What is the SMILES notation for N,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine?
The canonical SMILES for N,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine is CCNC1CC(OC2CCOC2)C1(CC)CC.
What is the InChIKey of N,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine?
The InChIKey is WBSHYLCTJYGGOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-4-14(5-2)12(15-6-3)9-13(14)17-11-7-8-16-10-11/h11-13,15H,4-10H2,1-3H3.
What are the key properties of N,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine?
N,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine has a molecular weight of 241.37 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-triethyl-3-(oxolan-3-yloxy)cyclobutan-1-amine is sourced from PubChem (CID 66350491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).