N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine

C11H23NO2 — CID 103033606

IUPACN-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine
SMILESCOC(C)(C)CCNC1(C)CCOC1
InChIInChI=1S/C11H23NO2/c1-10(2,13-4)5-7-12-11(3)6-8-14-9-11/h12H,5-9H2,1-4H3
InChIKeyPDBZMKXPJKDKQC-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.57
Rot. Bonds5

About N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine

N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine (PubChem CID 103033606) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine.

Molecular Properties

Compound NameN-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine
PubChem CID103033606
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine
SMILESCOC(C)(C)CCNC1(C)CCOC1
InChIInChI=1S/C11H23NO2/c1-10(2,13-4)5-7-12-11(3)6-8-14-9-11/h12H,5-9H2,1-4H3
InChIKeyPDBZMKXPJKDKQC-UHFFFAOYSA-N
XLogP1.57
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine?
The IUPAC name of N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine (CID 103033606) is N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine.
What is the SMILES notation for N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine?
The canonical SMILES for N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine is COC(C)(C)CCNC1(C)CCOC1.
What is the InChIKey of N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine?
The InChIKey is PDBZMKXPJKDKQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-10(2,13-4)5-7-12-11(3)6-8-14-9-11/h12H,5-9H2,1-4H3.
What are the key properties of N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine?
N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine has a molecular weight of 201.31 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxy-3-methylbutyl)-3-methyloxolan-3-amine is sourced from PubChem (CID 103033606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).