4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine

C9H16N2 — CID 155373367

IUPAC4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine
SMILESC1=C(C2CCNCC2)NCC1
InChIInChI=1S/C9H16N2/c1-2-9(11-5-1)8-3-6-10-7-4-8/h2,8,10-11H,1,3-7H2
InChIKeyWRGXHCGKQBRWAC-UHFFFAOYSA-N
MW152.24 g/mol
LogP0.86
Rot. Bonds1

About 4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine

4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine (PubChem CID 155373367) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine
PubChem CID155373367
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine
SMILESC1=C(C2CCNCC2)NCC1
InChIInChI=1S/C9H16N2/c1-2-9(11-5-1)8-3-6-10-7-4-8/h2,8,10-11H,1,3-7H2
InChIKeyWRGXHCGKQBRWAC-UHFFFAOYSA-N
XLogP0.86
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine?
The IUPAC name of 4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine (CID 155373367) is 4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine.
What is the SMILES notation for 4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine?
The canonical SMILES for 4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine is C1=C(C2CCNCC2)NCC1.
What is the InChIKey of 4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine?
The InChIKey is WRGXHCGKQBRWAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-2-9(11-5-1)8-3-6-10-7-4-8/h2,8,10-11H,1,3-7H2.
What are the key properties of 4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine?
4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine has a molecular weight of 152.24 g/mol, XLogP of 0.86, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-pyrrol-5-yl)piperidine is sourced from PubChem (CID 155373367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).