1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole

C12H19N3 — CID 56781208

IUPAC1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole
SMILESc1cnn(C2CN(CC3CCCC3)C2)c1
InChIInChI=1S/C12H19N3/c1-2-5-11(4-1)8-14-9-12(10-14)15-7-3-6-13-15/h3,6-7,11-12H,1-2,4-5,8-10H2
InChIKeyBWXQHONKNDRDJG-UHFFFAOYSA-N
MW205.30 g/mol
LogP1.93
Rot. Bonds3

About 1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole

1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole (PubChem CID 56781208) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole.

Molecular Properties

Compound Name1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole
PubChem CID56781208
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC Name1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole
SMILESc1cnn(C2CN(CC3CCCC3)C2)c1
InChIInChI=1S/C12H19N3/c1-2-5-11(4-1)8-14-9-12(10-14)15-7-3-6-13-15/h3,6-7,11-12H,1-2,4-5,8-10H2
InChIKeyBWXQHONKNDRDJG-UHFFFAOYSA-N
XLogP1.93
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole?
The IUPAC name of 1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole (CID 56781208) is 1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole.
What is the SMILES notation for 1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole?
The canonical SMILES for 1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole is c1cnn(C2CN(CC3CCCC3)C2)c1.
What is the InChIKey of 1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole?
The InChIKey is BWXQHONKNDRDJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-2-5-11(4-1)8-14-9-12(10-14)15-7-3-6-13-15/h3,6-7,11-12H,1-2,4-5,8-10H2.
What are the key properties of 1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole?
1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole has a molecular weight of 205.30 g/mol, XLogP of 1.93, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclopentylmethyl)azetidin-3-yl]pyrazole is sourced from PubChem (CID 56781208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).