1-methyl-3-pyrrolidin-2-ylpiperidine

C10H20N2 — CID 4020197

IUPAC1-methyl-3-pyrrolidin-2-ylpiperidine
SMILESCN1CCCC(C2CCCN2)C1
InChIInChI=1S/C10H20N2/c1-12-7-3-4-9(8-12)10-5-2-6-11-10/h9-11H,2-8H2,1H3
InChIKeyDUVQFTFUAMXIGS-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.08
Rot. Bonds1

About 1-methyl-3-pyrrolidin-2-ylpiperidine

1-methyl-3-pyrrolidin-2-ylpiperidine (PubChem CID 4020197) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-methyl-3-pyrrolidin-2-ylpiperidine.

Molecular Properties

Compound Name1-methyl-3-pyrrolidin-2-ylpiperidine
PubChem CID4020197
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name1-methyl-3-pyrrolidin-2-ylpiperidine
SMILESCN1CCCC(C2CCCN2)C1
InChIInChI=1S/C10H20N2/c1-12-7-3-4-9(8-12)10-5-2-6-11-10/h9-11H,2-8H2,1H3
InChIKeyDUVQFTFUAMXIGS-UHFFFAOYSA-N
XLogP1.08
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-pyrrolidin-2-ylpiperidine?
The IUPAC name of 1-methyl-3-pyrrolidin-2-ylpiperidine (CID 4020197) is 1-methyl-3-pyrrolidin-2-ylpiperidine.
What is the SMILES notation for 1-methyl-3-pyrrolidin-2-ylpiperidine?
The canonical SMILES for 1-methyl-3-pyrrolidin-2-ylpiperidine is CN1CCCC(C2CCCN2)C1.
What is the InChIKey of 1-methyl-3-pyrrolidin-2-ylpiperidine?
The InChIKey is DUVQFTFUAMXIGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-12-7-3-4-9(8-12)10-5-2-6-11-10/h9-11H,2-8H2,1H3.
What are the key properties of 1-methyl-3-pyrrolidin-2-ylpiperidine?
1-methyl-3-pyrrolidin-2-ylpiperidine has a molecular weight of 168.28 g/mol, XLogP of 1.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-pyrrolidin-2-ylpiperidine is sourced from PubChem (CID 4020197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).