2-pyrrolidin-1-ylcyclopentene-1-carbonitrile

C10H14N2 — CID 10397110

IUPAC2-pyrrolidin-1-ylcyclopentene-1-carbonitrile
SMILESN#CC1=C(N2CCCC2)CCC1
InChIInChI=1S/C10H14N2/c11-8-9-4-3-5-10(9)12-6-1-2-7-12/h1-7H2
InChIKeyOKVNBWYSFLXPJC-UHFFFAOYSA-N
MW162.24 g/mol
LogP2.04
Rot. Bonds1

About 2-pyrrolidin-1-ylcyclopentene-1-carbonitrile

2-pyrrolidin-1-ylcyclopentene-1-carbonitrile (PubChem CID 10397110) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 2-pyrrolidin-1-ylcyclopentene-1-carbonitrile.

Molecular Properties

Compound Name2-pyrrolidin-1-ylcyclopentene-1-carbonitrile
PubChem CID10397110
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name2-pyrrolidin-1-ylcyclopentene-1-carbonitrile
SMILESN#CC1=C(N2CCCC2)CCC1
InChIInChI=1S/C10H14N2/c11-8-9-4-3-5-10(9)12-6-1-2-7-12/h1-7H2
InChIKeyOKVNBWYSFLXPJC-UHFFFAOYSA-N
XLogP2.04
TPSA27.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-1-ylcyclopentene-1-carbonitrile?
The IUPAC name of 2-pyrrolidin-1-ylcyclopentene-1-carbonitrile (CID 10397110) is 2-pyrrolidin-1-ylcyclopentene-1-carbonitrile.
What is the SMILES notation for 2-pyrrolidin-1-ylcyclopentene-1-carbonitrile?
The canonical SMILES for 2-pyrrolidin-1-ylcyclopentene-1-carbonitrile is N#CC1=C(N2CCCC2)CCC1.
What is the InChIKey of 2-pyrrolidin-1-ylcyclopentene-1-carbonitrile?
The InChIKey is OKVNBWYSFLXPJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c11-8-9-4-3-5-10(9)12-6-1-2-7-12/h1-7H2.
What are the key properties of 2-pyrrolidin-1-ylcyclopentene-1-carbonitrile?
2-pyrrolidin-1-ylcyclopentene-1-carbonitrile has a molecular weight of 162.24 g/mol, XLogP of 2.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-1-ylcyclopentene-1-carbonitrile is sourced from PubChem (CID 10397110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).