4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine

C13H26N2O — CID 103575207

IUPAC4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine
SMILESCC1CN(C2CC(C)(C)OC2(C)C)CC1N
InChIInChI=1S/C13H26N2O/c1-9-7-15(8-10(9)14)11-6-12(2,3)16-13(11,4)5/h9-11H,6-8,14H2,1-5H3
InChIKeyIPWGNNRHFGISMZ-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.61
Rot. Bonds1

About 4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine

4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine (PubChem CID 103575207) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine.

Molecular Properties

Compound Name4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine
PubChem CID103575207
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine
SMILESCC1CN(C2CC(C)(C)OC2(C)C)CC1N
InChIInChI=1S/C13H26N2O/c1-9-7-15(8-10(9)14)11-6-12(2,3)16-13(11,4)5/h9-11H,6-8,14H2,1-5H3
InChIKeyIPWGNNRHFGISMZ-UHFFFAOYSA-N
XLogP1.61
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,2,5,5-tetramethyloxolan-3-yl)azetidin-3-ol
CID 114623874
1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-amine
CID 79926969
1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidine-3-carboxylic acid
CID 79934218
1-(2,2,5,5-tetramethyloxolan-3-yl)piperidine-3-carbothioamide
CID 114621322
1-(2,2,5,5-tetramethyloxolan-3-yl)piperidine-4-carboxylic acid
CID 79933599
2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine
CID 79926978
(3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine
CID 124709446
3-cyclopropyl-1-(2,2,5,5-tetramethyloxolan-3-yl)azetidin-3-ol
CID 114623881
3-ethyl-N-propyl-1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-amine
CID 114620933
[6,6-dimethyl-4-(2,2,5,5-tetramethyloxolan-3-yl)morpholin-2-yl]methanol
CID 114779914
[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-3-yl]methanol
CID 114623860
1-(2,2,5,5-tetramethyloxolan-3-yl)-1,2,4-triazol-3-amine
CID 114621254

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine?
The IUPAC name of 4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine (CID 103575207) is 4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine.
What is the SMILES notation for 4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine?
The canonical SMILES for 4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine is CC1CN(C2CC(C)(C)OC2(C)C)CC1N.
What is the InChIKey of 4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine?
The InChIKey is IPWGNNRHFGISMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-9-7-15(8-10(9)14)11-6-12(2,3)16-13(11,4)5/h9-11H,6-8,14H2,1-5H3.
What are the key properties of 4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine?
4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine has a molecular weight of 226.36 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)pyrrolidin-3-amine is sourced from PubChem (CID 103575207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).