2,3,7,8-tetrahydro-1H-pyrrolizine

C7H11N — CID 70384253

IUPAC2,3,7,8-tetrahydro-1H-pyrrolizine
SMILESC1=CN2CCCC2C1
InChIInChI=1S/C7H11N/c1-3-7-4-2-6-8(7)5-1/h1,5,7H,2-4,6H2
InChIKeySKFUDSXMJPHUCO-UHFFFAOYSA-N
MW109.17 g/mol
LogP1.37
Rot. Bonds

About 2,3,7,8-tetrahydro-1H-pyrrolizine

2,3,7,8-tetrahydro-1H-pyrrolizine (PubChem CID 70384253) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is 2,3,7,8-tetrahydro-1H-pyrrolizine.

Molecular Properties

Compound Name2,3,7,8-tetrahydro-1H-pyrrolizine
PubChem CID70384253
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name2,3,7,8-tetrahydro-1H-pyrrolizine
SMILESC1=CN2CCCC2C1
InChIInChI=1S/C7H11N/c1-3-7-4-2-6-8(7)5-1/h1,5,7H,2-4,6H2
InChIKeySKFUDSXMJPHUCO-UHFFFAOYSA-N
XLogP1.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.17
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3,7,8-tetrahydro-1H-pyrrolizine?
The IUPAC name of 2,3,7,8-tetrahydro-1H-pyrrolizine (CID 70384253) is 2,3,7,8-tetrahydro-1H-pyrrolizine.
What is the SMILES notation for 2,3,7,8-tetrahydro-1H-pyrrolizine?
The canonical SMILES for 2,3,7,8-tetrahydro-1H-pyrrolizine is C1=CN2CCCC2C1.
What is the InChIKey of 2,3,7,8-tetrahydro-1H-pyrrolizine?
The InChIKey is SKFUDSXMJPHUCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N/c1-3-7-4-2-6-8(7)5-1/h1,5,7H,2-4,6H2.
What are the key properties of 2,3,7,8-tetrahydro-1H-pyrrolizine?
2,3,7,8-tetrahydro-1H-pyrrolizine has a molecular weight of 109.17 g/mol, XLogP of 1.37, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,7,8-tetrahydro-1H-pyrrolizine is sourced from PubChem (CID 70384253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).