1-(cyclohexen-1-yl)-2-methylpyrrolidine

C11H19N — CID 4674520

IUPAC1-(cyclohexen-1-yl)-2-methylpyrrolidine
SMILESCC1CCCN1C1=CCCCC1
InChIInChI=1S/C11H19N/c1-10-6-5-9-12(10)11-7-3-2-4-8-11/h7,10H,2-6,8-9H2,1H3
InChIKeyBHPIFKGSQOHIII-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.93
Rot. Bonds1

About 1-(cyclohexen-1-yl)-2-methylpyrrolidine

1-(cyclohexen-1-yl)-2-methylpyrrolidine (PubChem CID 4674520) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 1-(cyclohexen-1-yl)-2-methylpyrrolidine.

Molecular Properties

Compound Name1-(cyclohexen-1-yl)-2-methylpyrrolidine
PubChem CID4674520
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name1-(cyclohexen-1-yl)-2-methylpyrrolidine
SMILESCC1CCCN1C1=CCCCC1
InChIInChI=1S/C11H19N/c1-10-6-5-9-12(10)11-7-3-2-4-8-11/h7,10H,2-6,8-9H2,1H3
InChIKeyBHPIFKGSQOHIII-UHFFFAOYSA-N
XLogP2.93
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexen-1-yl)-2-methylpyrrolidine?
The IUPAC name of 1-(cyclohexen-1-yl)-2-methylpyrrolidine (CID 4674520) is 1-(cyclohexen-1-yl)-2-methylpyrrolidine.
What is the SMILES notation for 1-(cyclohexen-1-yl)-2-methylpyrrolidine?
The canonical SMILES for 1-(cyclohexen-1-yl)-2-methylpyrrolidine is CC1CCCN1C1=CCCCC1.
What is the InChIKey of 1-(cyclohexen-1-yl)-2-methylpyrrolidine?
The InChIKey is BHPIFKGSQOHIII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-10-6-5-9-12(10)11-7-3-2-4-8-11/h7,10H,2-6,8-9H2,1H3.
What are the key properties of 1-(cyclohexen-1-yl)-2-methylpyrrolidine?
1-(cyclohexen-1-yl)-2-methylpyrrolidine has a molecular weight of 165.28 g/mol, XLogP of 2.93, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexen-1-yl)-2-methylpyrrolidine is sourced from PubChem (CID 4674520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).