1-(5-methylcyclohexen-1-yl)pyrrolidine

C11H19N — CID 12952197

IUPAC1-(5-methylcyclohexen-1-yl)pyrrolidine
SMILESCC1CCC=C(N2CCCC2)C1
InChIInChI=1S/C11H19N/c1-10-5-4-6-11(9-10)12-7-2-3-8-12/h6,10H,2-5,7-9H2,1H3
InChIKeyULWQYNWRSDEUDP-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.79
Rot. Bonds1

About 1-(5-methylcyclohexen-1-yl)pyrrolidine

1-(5-methylcyclohexen-1-yl)pyrrolidine (PubChem CID 12952197) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 1-(5-methylcyclohexen-1-yl)pyrrolidine.

Molecular Properties

Compound Name1-(5-methylcyclohexen-1-yl)pyrrolidine
PubChem CID12952197
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name1-(5-methylcyclohexen-1-yl)pyrrolidine
SMILESCC1CCC=C(N2CCCC2)C1
InChIInChI=1S/C11H19N/c1-10-5-4-6-11(9-10)12-7-2-3-8-12/h6,10H,2-5,7-9H2,1H3
InChIKeyULWQYNWRSDEUDP-UHFFFAOYSA-N
XLogP2.79
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 ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methylcyclohexen-1-yl)pyrrolidine?
The IUPAC name of 1-(5-methylcyclohexen-1-yl)pyrrolidine (CID 12952197) is 1-(5-methylcyclohexen-1-yl)pyrrolidine.
What is the SMILES notation for 1-(5-methylcyclohexen-1-yl)pyrrolidine?
The canonical SMILES for 1-(5-methylcyclohexen-1-yl)pyrrolidine is CC1CCC=C(N2CCCC2)C1.
What is the InChIKey of 1-(5-methylcyclohexen-1-yl)pyrrolidine?
The InChIKey is ULWQYNWRSDEUDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-10-5-4-6-11(9-10)12-7-2-3-8-12/h6,10H,2-5,7-9H2,1H3.
What are the key properties of 1-(5-methylcyclohexen-1-yl)pyrrolidine?
1-(5-methylcyclohexen-1-yl)pyrrolidine has a molecular weight of 165.28 g/mol, XLogP of 2.79, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylcyclohexen-1-yl)pyrrolidine is sourced from PubChem (CID 12952197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).