(2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine

C12H21N — CID 134854101

IUPAC(2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine
SMILESC[C@@H]1CCCN1C=C1CCCCC1
InChIInChI=1S/C12H21N/c1-11-6-5-9-13(11)10-12-7-3-2-4-8-12/h10-11H,2-9H2,1H3/t11-/m1/s1
InChIKeyLBGPWJVPOUAAQS-LLVKDONJSA-N
MW179.31 g/mol
LogP3.32
Rot. Bonds1

About (2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine

(2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine (PubChem CID 134854101) has the molecular formula C12H21N and a molecular weight of 179.31 g/mol. Its IUPAC name is (2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine.

Molecular Properties

Compound Name(2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine
PubChem CID134854101
Molecular FormulaC12H21N
Molecular Weight179.31 g/mol
Exact Mass179.17
IUPAC Name(2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine
SMILESC[C@@H]1CCCN1C=C1CCCCC1
InChIInChI=1S/C12H21N/c1-11-6-5-9-13(11)10-12-7-3-2-4-8-12/h10-11H,2-9H2,1H3/t11-/m1/s1
InChIKeyLBGPWJVPOUAAQS-LLVKDONJSA-N
XLogP3.32
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.31
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine?
The IUPAC name of (2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine (CID 134854101) is (2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine.
What is the SMILES notation for (2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine?
The canonical SMILES for (2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine is C[C@@H]1CCCN1C=C1CCCCC1.
What is the InChIKey of (2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine?
The InChIKey is LBGPWJVPOUAAQS-LLVKDONJSA-N. The full InChI is InChI=1S/C12H21N/c1-11-6-5-9-13(11)10-12-7-3-2-4-8-12/h10-11H,2-9H2,1H3/t11-/m1/s1.
What are the key properties of (2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine?
(2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine has a molecular weight of 179.31 g/mol, XLogP of 3.32, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(cyclohexylidenemethyl)-2-methylpyrrolidine is sourced from PubChem (CID 134854101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).