(4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone

C11H18N2O — CID 130765902

IUPAC(4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone
SMILESC=C1CCN(C(=O)[C@H]2CCCN2)CC1
InChIInChI=1S/C11H18N2O/c1-9-4-7-13(8-5-9)11(14)10-3-2-6-12-10/h10,12H,1-8H2/t10-/m1/s1
InChIKeyPDSSGECXNYFGMM-SNVBAGLBSA-N
MW194.28 g/mol
LogP0.92
Rot. Bonds1

About (4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone

(4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone (PubChem CID 130765902) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is (4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone.

Molecular Properties

Compound Name(4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone
PubChem CID130765902
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name(4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone
SMILESC=C1CCN(C(=O)[C@H]2CCCN2)CC1
InChIInChI=1S/C11H18N2O/c1-9-4-7-13(8-5-9)11(14)10-3-2-6-12-10/h10,12H,1-8H2/t10-/m1/s1
InChIKeyPDSSGECXNYFGMM-SNVBAGLBSA-N
XLogP0.92
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone with MolForge

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

Launch Full Analysis

Related Compounds

pyrrolidin-1-yl(pyrrolidin-2-yl)methanone
CID 550904
morpholin-4-yl-[(2R)-pyrrolidin-2-yl]methanone
CID 7175775
(4-aminopiperidin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 131224010
1,2,5-dithiazepan-5-yl-[(2R)-pyrrolidin-2-yl]methanone
CID 131153732
cyclopropyl-[4-[(2S)-pyrrolidine-2-carbonyl]piperazin-1-yl]methanone;hydrochloride
CID 71888790
(4-aminopiperidin-1-yl)-pyrrolidin-2-ylmethanone
CID 110461351
(4-methylpiperazin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone;dihydrochloride
CID 165429624
azepan-1-yl(azepan-2-yl)methanone
CID 64562203
azepan-1-yl-[(2R)-piperidin-2-yl]methanone
CID 7183049
1-[4-[(2S)-pyrrolidine-2-carbonyl]-1,4-diazepan-1-yl]ethanone
CID 55002826
1,4-diazepan-1-yl-[(2S)-pyrrolidin-2-yl]methanone
CID 61154711
pyrrolidin-2-yl(1,4,7-trioxa-10-azacyclododec-10-yl)methanone
CID 3095254

Frequently Asked Questions

What is the IUPAC name of (4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone?
The IUPAC name of (4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone (CID 130765902) is (4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone.
What is the SMILES notation for (4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone?
The canonical SMILES for (4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone is C=C1CCN(C(=O)[C@H]2CCCN2)CC1.
What is the InChIKey of (4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone?
The InChIKey is PDSSGECXNYFGMM-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9-4-7-13(8-5-9)11(14)10-3-2-6-12-10/h10,12H,1-8H2/t10-/m1/s1.
What are the key properties of (4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone?
(4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone has a molecular weight of 194.28 g/mol, XLogP of 0.92, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylidenepiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone is sourced from PubChem (CID 130765902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).