[3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine

C12H23NO2 — CID 65051674

IUPAC[3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine
SMILESCC1CCC(CN)(OCC2CCCO2)C1
InChIInChI=1S/C12H23NO2/c1-10-4-5-12(7-10,9-13)15-8-11-3-2-6-14-11/h10-11H,2-9,13H2,1H3
InChIKeyIBRSBTPLSQQUJZ-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.70
Rot. Bonds4

About [3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine

[3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine (PubChem CID 65051674) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is [3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine.

Molecular Properties

Compound Name[3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine
PubChem CID65051674
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name[3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine
SMILESCC1CCC(CN)(OCC2CCCO2)C1
InChIInChI=1S/C12H23NO2/c1-10-4-5-12(7-10,9-13)15-8-11-3-2-6-14-11/h10-11H,2-9,13H2,1H3
InChIKeyIBRSBTPLSQQUJZ-UHFFFAOYSA-N
XLogP1.70
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4,4-dimethyl-1-(oxolan-2-ylmethoxy)cyclohexyl]methanamine
CID 65050953
[1-(oxolan-2-ylmethoxy)-4-propan-2-ylcyclohexyl]methanamine
CID 62107413
[1-(cyclobutylmethoxy)-3-methylcyclopentyl]methanamine
CID 65458688
2-[[1-(iodomethyl)-3-methylcyclohexyl]oxymethyl]oxane
CID 114772658
2-methyl-N-[[3-methyl-1-(oxolan-2-ylmethoxy)cyclohexyl]methyl]propan-2-amine
CID 62110273
2-[[4-tert-butyl-1-(iodomethyl)cyclohexyl]oxymethyl]oxolane
CID 114773000
[4-tert-butyl-1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine
CID 65158713
[1-(3,3-dimethylbutoxy)-3-methylcyclopentyl]methanamine
CID 65052054
[1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine
CID 65158471
1-(aminomethyl)-N-ethyl-3-methyl-N-(oxolan-2-ylmethyl)cyclobutan-1-amine
CID 103562711
[1-[3-(oxolan-2-yl)propoxy]-4-propan-2-ylcyclohexyl]methanamine
CID 65158667
2-methyl-N-[[1-(oxolan-2-ylmethoxy)cyclohexyl]methyl]propan-2-amine
CID 62107941

Frequently Asked Questions

What is the IUPAC name of [3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine?
The IUPAC name of [3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine (CID 65051674) is [3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine.
What is the SMILES notation for [3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine?
The canonical SMILES for [3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine is CC1CCC(CN)(OCC2CCCO2)C1.
What is the InChIKey of [3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine?
The InChIKey is IBRSBTPLSQQUJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-10-4-5-12(7-10,9-13)15-8-11-3-2-6-14-11/h10-11H,2-9,13H2,1H3.
What are the key properties of [3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine?
[3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine has a molecular weight of 213.32 g/mol, XLogP of 1.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine is sourced from PubChem (CID 65051674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).