5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole

C11H17N3 — CID 95841069

IUPAC5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole
SMILESc1cc(C2CN(C3CCCC3)C2)[nH]n1
InChIInChI=1S/C11H17N3/c1-2-4-10(3-1)14-7-9(8-14)11-5-6-12-13-11/h5-6,9-10H,1-4,7-8H2,(H,12,13)
InChIKeyMFKVTQAKOYRBAA-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.75
Rot. Bonds2

About 5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole

5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole (PubChem CID 95841069) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole.

Molecular Properties

Compound Name5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole
PubChem CID95841069
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole
SMILESc1cc(C2CN(C3CCCC3)C2)[nH]n1
InChIInChI=1S/C11H17N3/c1-2-4-10(3-1)14-7-9(8-14)11-5-6-12-13-11/h5-6,9-10H,1-4,7-8H2,(H,12,13)
InChIKeyMFKVTQAKOYRBAA-UHFFFAOYSA-N
XLogP1.75
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 126624087
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CID 132344522
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CID 73440312
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CID 95841083
CID 95841083
CID 110249240
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CID 110250157
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Frequently Asked Questions

What is the IUPAC name of 5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole?
The IUPAC name of 5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole (CID 95841069) is 5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole.
What is the SMILES notation for 5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole?
The canonical SMILES for 5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole is c1cc(C2CN(C3CCCC3)C2)[nH]n1.
What is the InChIKey of 5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole?
The InChIKey is MFKVTQAKOYRBAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-2-4-10(3-1)14-7-9(8-14)11-5-6-12-13-11/h5-6,9-10H,1-4,7-8H2,(H,12,13).
What are the key properties of 5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole?
5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole has a molecular weight of 191.28 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-cyclopentylazetidin-3-yl)-1H-pyrazole is sourced from PubChem (CID 95841069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).