1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine

C12H19N — CID 18511210

IUPAC1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine
SMILESC=C(C1=C(C)CCC1)N1CCCC1
InChIInChI=1S/C12H19N/c1-10-6-5-7-12(10)11(2)13-8-3-4-9-13/h2-9H2,1H3
InChIKeyXKZMXLSDARTQSI-UHFFFAOYSA-N
MW177.29 g/mol
LogP3.10
Rot. Bonds2

About 1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine

1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine (PubChem CID 18511210) has the molecular formula C12H19N and a molecular weight of 177.29 g/mol. Its IUPAC name is 1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine.

Molecular Properties

Compound Name1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine
PubChem CID18511210
Molecular FormulaC12H19N
Molecular Weight177.29 g/mol
Exact Mass177.15
IUPAC Name1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine
SMILESC=C(C1=C(C)CCC1)N1CCCC1
InChIInChI=1S/C12H19N/c1-10-6-5-7-12(10)11(2)13-8-3-4-9-13/h2-9H2,1H3
InChIKeyXKZMXLSDARTQSI-UHFFFAOYSA-N
XLogP3.10
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.29
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine?
The IUPAC name of 1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine (CID 18511210) is 1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine.
What is the SMILES notation for 1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine?
The canonical SMILES for 1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine is C=C(C1=C(C)CCC1)N1CCCC1.
What is the InChIKey of 1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine?
The InChIKey is XKZMXLSDARTQSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N/c1-10-6-5-7-12(10)11(2)13-8-3-4-9-13/h2-9H2,1H3.
What are the key properties of 1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine?
1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine has a molecular weight of 177.29 g/mol, XLogP of 3.10, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methylcyclopenten-1-yl)ethenyl]pyrrolidine is sourced from PubChem (CID 18511210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).