1-cyclopentyl-4-(furan-2-yloxy)pyrazole

C12H14N2O2 — CID 117233995

IUPAC1-cyclopentyl-4-(furan-2-yloxy)pyrazole
SMILESc1coc(Oc2cnn(C3CCCC3)c2)c1
InChIInChI=1S/C12H14N2O2/c1-2-5-10(4-1)14-9-11(8-13-14)16-12-6-3-7-15-12/h3,6-10H,1-2,4-5H2
InChIKeyWYPBYLJBDQZFSZ-UHFFFAOYSA-N
MW218.26 g/mol
LogP3.38
Rot. Bonds3

About 1-cyclopentyl-4-(furan-2-yloxy)pyrazole

1-cyclopentyl-4-(furan-2-yloxy)pyrazole (PubChem CID 117233995) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 1-cyclopentyl-4-(furan-2-yloxy)pyrazole.

Molecular Properties

Compound Name1-cyclopentyl-4-(furan-2-yloxy)pyrazole
PubChem CID117233995
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name1-cyclopentyl-4-(furan-2-yloxy)pyrazole
SMILESc1coc(Oc2cnn(C3CCCC3)c2)c1
InChIInChI=1S/C12H14N2O2/c1-2-5-10(4-1)14-9-11(8-13-14)16-12-6-3-7-15-12/h3,6-10H,1-2,4-5H2
InChIKeyWYPBYLJBDQZFSZ-UHFFFAOYSA-N
XLogP3.38
TPSA40.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-(furan-2-yloxy)pyrazole?
The IUPAC name of 1-cyclopentyl-4-(furan-2-yloxy)pyrazole (CID 117233995) is 1-cyclopentyl-4-(furan-2-yloxy)pyrazole.
What is the SMILES notation for 1-cyclopentyl-4-(furan-2-yloxy)pyrazole?
The canonical SMILES for 1-cyclopentyl-4-(furan-2-yloxy)pyrazole is c1coc(Oc2cnn(C3CCCC3)c2)c1.
What is the InChIKey of 1-cyclopentyl-4-(furan-2-yloxy)pyrazole?
The InChIKey is WYPBYLJBDQZFSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-2-5-10(4-1)14-9-11(8-13-14)16-12-6-3-7-15-12/h3,6-10H,1-2,4-5H2.
What are the key properties of 1-cyclopentyl-4-(furan-2-yloxy)pyrazole?
1-cyclopentyl-4-(furan-2-yloxy)pyrazole has a molecular weight of 218.26 g/mol, XLogP of 3.38, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-(furan-2-yloxy)pyrazole is sourced from PubChem (CID 117233995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).