2-cyclopentyl-2-piperidin-1-ylacetonitrile

C12H20N2 — CID 62071262

IUPAC2-cyclopentyl-2-piperidin-1-ylacetonitrile
SMILESN#CC(C1CCCC1)N1CCCCC1
InChIInChI=1S/C12H20N2/c13-10-12(11-6-2-3-7-11)14-8-4-1-5-9-14/h11-12H,1-9H2
InChIKeyFZJVMUJNRYSSFX-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.55
Rot. Bonds2

About 2-cyclopentyl-2-piperidin-1-ylacetonitrile

2-cyclopentyl-2-piperidin-1-ylacetonitrile (PubChem CID 62071262) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 2-cyclopentyl-2-piperidin-1-ylacetonitrile.

Molecular Properties

Compound Name2-cyclopentyl-2-piperidin-1-ylacetonitrile
PubChem CID62071262
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name2-cyclopentyl-2-piperidin-1-ylacetonitrile
SMILESN#CC(C1CCCC1)N1CCCCC1
InChIInChI=1S/C12H20N2/c13-10-12(11-6-2-3-7-11)14-8-4-1-5-9-14/h11-12H,1-9H2
InChIKeyFZJVMUJNRYSSFX-UHFFFAOYSA-N
XLogP2.55
TPSA27.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-piperidin-1-ylacetonitrile?
The IUPAC name of 2-cyclopentyl-2-piperidin-1-ylacetonitrile (CID 62071262) is 2-cyclopentyl-2-piperidin-1-ylacetonitrile.
What is the SMILES notation for 2-cyclopentyl-2-piperidin-1-ylacetonitrile?
The canonical SMILES for 2-cyclopentyl-2-piperidin-1-ylacetonitrile is N#CC(C1CCCC1)N1CCCCC1.
What is the InChIKey of 2-cyclopentyl-2-piperidin-1-ylacetonitrile?
The InChIKey is FZJVMUJNRYSSFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c13-10-12(11-6-2-3-7-11)14-8-4-1-5-9-14/h11-12H,1-9H2.
What are the key properties of 2-cyclopentyl-2-piperidin-1-ylacetonitrile?
2-cyclopentyl-2-piperidin-1-ylacetonitrile has a molecular weight of 192.31 g/mol, XLogP of 2.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-piperidin-1-ylacetonitrile is sourced from PubChem (CID 62071262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).