4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine

C14H29NO2 — CID 103032411

IUPAC4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine
SMILESCOC(C)(C)CCC(N)C1C(C)OC(C)C1C
InChIInChI=1S/C14H29NO2/c1-9-10(2)17-11(3)13(9)12(15)7-8-14(4,5)16-6/h9-13H,7-8,15H2,1-6H3
InChIKeyVMNVAXIFUROKTK-UHFFFAOYSA-N
MW243.39 g/mol
LogP2.58
Rot. Bonds5

About 4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine

4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine (PubChem CID 103032411) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine.

Molecular Properties

Compound Name4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine
PubChem CID103032411
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine
SMILESCOC(C)(C)CCC(N)C1C(C)OC(C)C1C
InChIInChI=1S/C14H29NO2/c1-9-10(2)17-11(3)13(9)12(15)7-8-14(4,5)16-6/h9-13H,7-8,15H2,1-6H3
InChIKeyVMNVAXIFUROKTK-UHFFFAOYSA-N
XLogP2.58
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
CID 105008984
4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine
CID 103032155
3-cyclohexyl-1-(2,4,5-trimethyloxolan-3-yl)propan-1-amine
CID 114193118
3-(4-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)propan-1-amine
CID 115864775
4-methoxy-2-methyl-1-(2,4,5-trimethyloxolan-3-yl)butan-1-amine
CID 105044706
1-(3,4-dihydro-2H-chromen-4-yl)-4-methoxy-4-methylpentan-1-amine
CID 103032406
1-(1,4-dithian-2-yl)-4-methoxy-4-methylpentan-1-amine
CID 103035921
1-(3-ethylcyclopentyl)-4-methoxy-4-methylpentan-1-amine
CID 103035740
1-(2-bicyclo[2.2.1]heptanyl)-4-methoxy-4-methylpentan-1-amine
CID 103032021
2-(4-methylphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
CID 65155888
4-methoxy-4-methyl-1-(2-phenylcyclopropyl)pentan-1-amine
CID 103031750
2-(4-bromophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
CID 65155737

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine?
The IUPAC name of 4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine (CID 103032411) is 4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine.
What is the SMILES notation for 4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine?
The canonical SMILES for 4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine is COC(C)(C)CCC(N)C1C(C)OC(C)C1C.
What is the InChIKey of 4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine?
The InChIKey is VMNVAXIFUROKTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-9-10(2)17-11(3)13(9)12(15)7-8-14(4,5)16-6/h9-13H,7-8,15H2,1-6H3.
What are the key properties of 4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine?
4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine has a molecular weight of 243.39 g/mol, XLogP of 2.58, 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-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine is sourced from PubChem (CID 103032411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).