(5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone

C11H18N2O — CID 139335393

IUPAC(5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone
SMILESC=C1CCC(C(=O)N2CCCCC2)N1
InChIInChI=1S/C11H18N2O/c1-9-5-6-10(12-9)11(14)13-7-3-2-4-8-13/h10,12H,1-8H2
InChIKeyHLFBUKUSZHZEOZ-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.26
Rot. Bonds1

About (5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone

(5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone (PubChem CID 139335393) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is (5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone
PubChem CID139335393
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name(5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone
SMILESC=C1CCC(C(=O)N2CCCCC2)N1
InChIInChI=1S/C11H18N2O/c1-9-5-6-10(12-9)11(14)13-7-3-2-4-8-13/h10,12H,1-8H2
InChIKeyHLFBUKUSZHZEOZ-UHFFFAOYSA-N
XLogP1.26
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 ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone?
The IUPAC name of (5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone (CID 139335393) is (5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone is C=C1CCC(C(=O)N2CCCCC2)N1.
What is the InChIKey of (5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone?
The InChIKey is HLFBUKUSZHZEOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9-5-6-10(12-9)11(14)13-7-3-2-4-8-13/h10,12H,1-8H2.
What are the key properties of (5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone?
(5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone has a molecular weight of 194.28 g/mol, XLogP of 1.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylidenepyrrolidin-2-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 139335393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).