1-pent-1-enylpyrrolidine

C9H17N — CID 573644

IUPAC1-pent-1-enylpyrrolidine
SMILESCCCC=CN1CCCC1
InChIInChI=1S/C9H17N/c1-2-3-4-7-10-8-5-6-9-10/h4,7H,2-3,5-6,8-9H2,1H3
InChIKeyGJCHANJVVGOMLB-UHFFFAOYSA-N
MW139.24 g/mol
LogP2.40
Rot. Bonds3

About 1-pent-1-enylpyrrolidine

1-pent-1-enylpyrrolidine (PubChem CID 573644) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 1-pent-1-enylpyrrolidine.

Molecular Properties

Compound Name1-pent-1-enylpyrrolidine
PubChem CID573644
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name1-pent-1-enylpyrrolidine
SMILESCCCC=CN1CCCC1
InChIInChI=1S/C9H17N/c1-2-3-4-7-10-8-5-6-9-10/h4,7H,2-3,5-6,8-9H2,1H3
InChIKeyGJCHANJVVGOMLB-UHFFFAOYSA-N
XLogP2.40
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-pent-1-enylpyrrolidine?
The IUPAC name of 1-pent-1-enylpyrrolidine (CID 573644) is 1-pent-1-enylpyrrolidine.
What is the SMILES notation for 1-pent-1-enylpyrrolidine?
The canonical SMILES for 1-pent-1-enylpyrrolidine is CCCC=CN1CCCC1.
What is the InChIKey of 1-pent-1-enylpyrrolidine?
The InChIKey is GJCHANJVVGOMLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-2-3-4-7-10-8-5-6-9-10/h4,7H,2-3,5-6,8-9H2,1H3.
What are the key properties of 1-pent-1-enylpyrrolidine?
1-pent-1-enylpyrrolidine has a molecular weight of 139.24 g/mol, XLogP of 2.40, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pent-1-enylpyrrolidine is sourced from PubChem (CID 573644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).