1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine

C11H20N2 — CID 89209704

IUPAC1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine
SMILESC=C1C[C@@H](N2CCCCC2)CN1C
InChIInChI=1S/C11H20N2/c1-10-8-11(9-12(10)2)13-6-4-3-5-7-13/h11H,1,3-9H2,2H3/t11-/m1/s1
InChIKeyCDDJTQFCUHDKLL-LLVKDONJSA-N
MW180.29 g/mol
LogP1.69
Rot. Bonds1

About 1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine

1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine (PubChem CID 89209704) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is 1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine.

Molecular Properties

Compound Name1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine
PubChem CID89209704
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine
SMILESC=C1C[C@@H](N2CCCCC2)CN1C
InChIInChI=1S/C11H20N2/c1-10-8-11(9-12(10)2)13-6-4-3-5-7-13/h11H,1,3-9H2,2H3/t11-/m1/s1
InChIKeyCDDJTQFCUHDKLL-LLVKDONJSA-N
XLogP1.69
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine?
The IUPAC name of 1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine (CID 89209704) is 1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine.
What is the SMILES notation for 1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine?
The canonical SMILES for 1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine is C=C1C[C@@H](N2CCCCC2)CN1C.
What is the InChIKey of 1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine?
The InChIKey is CDDJTQFCUHDKLL-LLVKDONJSA-N. The full InChI is InChI=1S/C11H20N2/c1-10-8-11(9-12(10)2)13-6-4-3-5-7-13/h11H,1,3-9H2,2H3/t11-/m1/s1.
What are the key properties of 1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine?
1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine has a molecular weight of 180.29 g/mol, XLogP of 1.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-1-methyl-5-methylidenepyrrolidin-3-yl]piperidine is sourced from PubChem (CID 89209704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).