4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol

C11H21NO2 — CID 63823124

IUPAC4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol
SMILESCC1(CNC2COCC2O)CCCC1
InChIInChI=1S/C11H21NO2/c1-11(4-2-3-5-11)8-12-9-6-14-7-10(9)13/h9-10,12-13H,2-8H2,1H3
InChIKeyBSJKVUAZJYEILX-UHFFFAOYSA-N
MW199.29 g/mol
LogP0.92
Rot. Bonds3

About 4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol

4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol (PubChem CID 63823124) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol.

Molecular Properties

Compound Name4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol
PubChem CID63823124
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol
SMILESCC1(CNC2COCC2O)CCCC1
InChIInChI=1S/C11H21NO2/c1-11(4-2-3-5-11)8-12-9-6-14-7-10(9)13/h9-10,12-13H,2-8H2,1H3
InChIKeyBSJKVUAZJYEILX-UHFFFAOYSA-N
XLogP0.92
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol?
The IUPAC name of 4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol (CID 63823124) is 4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol.
What is the SMILES notation for 4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol?
The canonical SMILES for 4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol is CC1(CNC2COCC2O)CCCC1.
What is the InChIKey of 4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol?
The InChIKey is BSJKVUAZJYEILX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-11(4-2-3-5-11)8-12-9-6-14-7-10(9)13/h9-10,12-13H,2-8H2,1H3.
What are the key properties of 4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol?
4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol has a molecular weight of 199.29 g/mol, XLogP of 0.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-methylcyclopentyl)methylamino]oxolan-3-ol is sourced from PubChem (CID 63823124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).