2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol

C11H22N2O — CID 60885248

IUPAC2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol
SMILESCN1CCC(CNC2CCCC2O)C1
InChIInChI=1S/C11H22N2O/c1-13-6-5-9(8-13)7-12-10-3-2-4-11(10)14/h9-12,14H,2-8H2,1H3
InChIKeyOLLLCOHRMSSWDN-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.44
Rot. Bonds3

About 2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol

2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol (PubChem CID 60885248) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol
PubChem CID60885248
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol
SMILESCN1CCC(CNC2CCCC2O)C1
InChIInChI=1S/C11H22N2O/c1-13-6-5-9(8-13)7-12-10-3-2-4-11(10)14/h9-12,14H,2-8H2,1H3
InChIKeyOLLLCOHRMSSWDN-UHFFFAOYSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol?
The IUPAC name of 2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol (CID 60885248) is 2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol.
What is the SMILES notation for 2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol?
The canonical SMILES for 2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol is CN1CCC(CNC2CCCC2O)C1.
What is the InChIKey of 2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol?
The InChIKey is OLLLCOHRMSSWDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-13-6-5-9(8-13)7-12-10-3-2-4-11(10)14/h9-12,14H,2-8H2,1H3.
What are the key properties of 2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol?
2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol has a molecular weight of 198.31 g/mol, XLogP of 0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methylpyrrolidin-3-yl)methylamino]cyclopentan-1-ol is sourced from PubChem (CID 60885248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).