4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine

C11H23NO2 — CID 103032335

IUPAC4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine
SMILESCOC(C)(C)CCC(N)C1CCCO1
InChIInChI=1S/C11H23NO2/c1-11(2,13-3)7-6-9(12)10-5-4-8-14-10/h9-10H,4-8,12H2,1-3H3
InChIKeyAOJRJNFPASKMNW-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.70
Rot. Bonds5

About 4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine

4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine (PubChem CID 103032335) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine.

Molecular Properties

Compound Name4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine
PubChem CID103032335
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine
SMILESCOC(C)(C)CCC(N)C1CCCO1
InChIInChI=1S/C11H23NO2/c1-11(2,13-3)7-6-9(12)10-5-4-8-14-10/h9-10H,4-8,12H2,1-3H3
InChIKeyAOJRJNFPASKMNW-UHFFFAOYSA-N
XLogP1.70
TPSA44.48 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 ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine?
The IUPAC name of 4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine (CID 103032335) is 4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine.
What is the SMILES notation for 4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine?
The canonical SMILES for 4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine is COC(C)(C)CCC(N)C1CCCO1.
What is the InChIKey of 4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine?
The InChIKey is AOJRJNFPASKMNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-11(2,13-3)7-6-9(12)10-5-4-8-14-10/h9-10H,4-8,12H2,1-3H3.
What are the key properties of 4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine?
4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine has a molecular weight of 201.31 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine is sourced from PubChem (CID 103032335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).