1-(pyrrolidin-2-ylmethyl)piperidine

C10H20N2 — CID 3973870

IUPAC1-(pyrrolidin-2-ylmethyl)piperidine
SMILESC1CCN(CC2CCCN2)CC1
InChIInChI=1S/C10H20N2/c1-2-7-12(8-3-1)9-10-5-4-6-11-10/h10-11H,1-9H2
InChIKeyMYIDBVVEYLMRSS-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.22
Rot. Bonds2

About 1-(pyrrolidin-2-ylmethyl)piperidine

1-(pyrrolidin-2-ylmethyl)piperidine (PubChem CID 3973870) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-(pyrrolidin-2-ylmethyl)piperidine.

Molecular Properties

Compound Name1-(pyrrolidin-2-ylmethyl)piperidine
PubChem CID3973870
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name1-(pyrrolidin-2-ylmethyl)piperidine
SMILESC1CCN(CC2CCCN2)CC1
InChIInChI=1S/C10H20N2/c1-2-7-12(8-3-1)9-10-5-4-6-11-10/h10-11H,1-9H2
InChIKeyMYIDBVVEYLMRSS-UHFFFAOYSA-N
XLogP1.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(pyrrolidin-2-ylmethyl)piperidine?
The IUPAC name of 1-(pyrrolidin-2-ylmethyl)piperidine (CID 3973870) is 1-(pyrrolidin-2-ylmethyl)piperidine.
What is the SMILES notation for 1-(pyrrolidin-2-ylmethyl)piperidine?
The canonical SMILES for 1-(pyrrolidin-2-ylmethyl)piperidine is C1CCN(CC2CCCN2)CC1.
What is the InChIKey of 1-(pyrrolidin-2-ylmethyl)piperidine?
The InChIKey is MYIDBVVEYLMRSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-2-7-12(8-3-1)9-10-5-4-6-11-10/h10-11H,1-9H2.
What are the key properties of 1-(pyrrolidin-2-ylmethyl)piperidine?
1-(pyrrolidin-2-ylmethyl)piperidine has a molecular weight of 168.28 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(pyrrolidin-2-ylmethyl)piperidine is sourced from PubChem (CID 3973870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).