5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole

C11H19N — CID 55264228

IUPAC5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole
SMILESCC1CCN=C1C1CCCCC1
InChIInChI=1S/C11H19N/c1-9-7-8-12-11(9)10-5-3-2-4-6-10/h9-10H,2-8H2,1H3
InChIKeyMUOGYQQBKUINEG-UHFFFAOYSA-N
MW165.28 g/mol
LogP3.05
Rot. Bonds1

About 5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole

5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole (PubChem CID 55264228) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole.

Molecular Properties

Compound Name5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole
PubChem CID55264228
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole
SMILESCC1CCN=C1C1CCCCC1
InChIInChI=1S/C11H19N/c1-9-7-8-12-11(9)10-5-3-2-4-6-10/h9-10H,2-8H2,1H3
InChIKeyMUOGYQQBKUINEG-UHFFFAOYSA-N
XLogP3.05
TPSA12.36 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 ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole?
The IUPAC name of 5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole (CID 55264228) is 5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole.
What is the SMILES notation for 5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole?
The canonical SMILES for 5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole is CC1CCN=C1C1CCCCC1.
What is the InChIKey of 5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole?
The InChIKey is MUOGYQQBKUINEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-9-7-8-12-11(9)10-5-3-2-4-6-10/h9-10H,2-8H2,1H3.
What are the key properties of 5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole?
5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole has a molecular weight of 165.28 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-4-methyl-3,4-dihydro-2H-pyrrole is sourced from PubChem (CID 55264228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).