cyclopenta[c]pyrazole;hydrochloride

C6H5ClN2 — CID 141400711

IUPACcyclopenta[c]pyrazole;hydrochloride
SMILESC1=CC2=CN=NC2=C1.Cl
InChIInChI=1S/C6H4N2.ClH/c1-2-5-4-7-8-6(5)3-1;/h1-4H;1H
InChIKeySXDPFUVGFQZQFU-UHFFFAOYSA-N
MW140.57 g/mol
LogP2.21
Rot. Bonds

About cyclopenta[c]pyrazole;hydrochloride

cyclopenta[c]pyrazole;hydrochloride (PubChem CID 141400711) has the molecular formula C6H5ClN2 and a molecular weight of 140.57 g/mol. Its IUPAC name is cyclopenta[c]pyrazole;hydrochloride.

Molecular Properties

Compound Namecyclopenta[c]pyrazole;hydrochloride
PubChem CID141400711
Molecular FormulaC6H5ClN2
Molecular Weight140.57 g/mol
Exact Mass140.01
IUPAC Namecyclopenta[c]pyrazole;hydrochloride
SMILESC1=CC2=CN=NC2=C1.Cl
InChIInChI=1S/C6H4N2.ClH/c1-2-5-4-7-8-6(5)3-1;/h1-4H;1H
InChIKeySXDPFUVGFQZQFU-UHFFFAOYSA-N
XLogP2.21
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.57
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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pentalene;vanadium
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cyclopenta[d]triazole
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carbon monoxide;pentalene;rhenium
CID 139264183
4,5,11,12-tetrazatricyclo[8.3.0.02,6]trideca-1(13),7,9,11-tetraene
CID 67871841
cyclopenta[b]pyrrol-2-ylmethylidene(dimethyl)silane
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ethane-1,2-diol;pentalene
CID 87106064
2-ethylcyclopenta[b]pyrrole;2-methylcyclopenta[b]pyrrole
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4H-cyclopenta[c]pyridin-3-amine
CID 175869974
bicyclo[7.7.0]hexadeca-1,3,5,7,9,11,13,15-octaene
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Frequently Asked Questions

What is the IUPAC name of cyclopenta[c]pyrazole;hydrochloride?
The IUPAC name of cyclopenta[c]pyrazole;hydrochloride (CID 141400711) is cyclopenta[c]pyrazole;hydrochloride.
What is the SMILES notation for cyclopenta[c]pyrazole;hydrochloride?
The canonical SMILES for cyclopenta[c]pyrazole;hydrochloride is C1=CC2=CN=NC2=C1.Cl.
What is the InChIKey of cyclopenta[c]pyrazole;hydrochloride?
The InChIKey is SXDPFUVGFQZQFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N2.ClH/c1-2-5-4-7-8-6(5)3-1;/h1-4H;1H.
What are the key properties of cyclopenta[c]pyrazole;hydrochloride?
cyclopenta[c]pyrazole;hydrochloride has a molecular weight of 140.57 g/mol, XLogP of 2.21, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta[c]pyrazole;hydrochloride is sourced from PubChem (CID 141400711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).