2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one

C10H17NO — CID 79543806

IUPAC2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one
SMILESCN1CCCC1C1CCCC1=O
InChIInChI=1S/C10H17NO/c1-11-7-3-5-9(11)8-4-2-6-10(8)12/h8-9H,2-7H2,1H3
InChIKeyIRTIOXKDIXYAHI-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.45
Rot. Bonds1

About 2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one

2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one (PubChem CID 79543806) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one.

Molecular Properties

Compound Name2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one
PubChem CID79543806
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one
SMILESCN1CCCC1C1CCCC1=O
InChIInChI=1S/C10H17NO/c1-11-7-3-5-9(11)8-4-2-6-10(8)12/h8-9H,2-7H2,1H3
InChIKeyIRTIOXKDIXYAHI-UHFFFAOYSA-N
XLogP1.45
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one?
The IUPAC name of 2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one (CID 79543806) is 2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one.
What is the SMILES notation for 2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one?
The canonical SMILES for 2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one is CN1CCCC1C1CCCC1=O.
What is the InChIKey of 2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one?
The InChIKey is IRTIOXKDIXYAHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-11-7-3-5-9(11)8-4-2-6-10(8)12/h8-9H,2-7H2,1H3.
What are the key properties of 2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one?
2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one has a molecular weight of 167.25 g/mol, XLogP of 1.45, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrrolidin-2-yl)cyclopentan-1-one is sourced from PubChem (CID 79543806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).