2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol

C12H23NO — CID 79857715

IUPAC2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol
SMILESCC1CCCN1C1CCC(C)(C)C1O
InChIInChI=1S/C12H23NO/c1-9-5-4-8-13(9)10-6-7-12(2,3)11(10)14/h9-11,14H,4-8H2,1-3H3
InChIKeyWNBOBGBANJLNIC-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.02
Rot. Bonds1

About 2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol

2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol (PubChem CID 79857715) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol
PubChem CID79857715
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol
SMILESCC1CCCN1C1CCC(C)(C)C1O
InChIInChI=1S/C12H23NO/c1-9-5-4-8-13(9)10-6-7-12(2,3)11(10)14/h9-11,14H,4-8H2,1-3H3
InChIKeyWNBOBGBANJLNIC-UHFFFAOYSA-N
XLogP2.02
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol?
The IUPAC name of 2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol (CID 79857715) is 2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol.
What is the SMILES notation for 2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol?
The canonical SMILES for 2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol is CC1CCCN1C1CCC(C)(C)C1O.
What is the InChIKey of 2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol?
The InChIKey is WNBOBGBANJLNIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-9-5-4-8-13(9)10-6-7-12(2,3)11(10)14/h9-11,14H,4-8H2,1-3H3.
What are the key properties of 2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol?
2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol has a molecular weight of 197.32 g/mol, XLogP of 2.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol is sourced from PubChem (CID 79857715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).