1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole

C6H10N2 — CID 154262601

IUPAC1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole
SMILESC1CC2=C(C1)NNC2
InChIInChI=1S/C6H10N2/c1-2-5-4-7-8-6(5)3-1/h7-8H,1-4H2
InChIKeyLHMLQNAGBIXGMS-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.53
Rot. Bonds

About 1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole

1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole (PubChem CID 154262601) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole.

Molecular Properties

Compound Name1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole
PubChem CID154262601
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole
SMILESC1CC2=C(C1)NNC2
InChIInChI=1S/C6H10N2/c1-2-5-4-7-8-6(5)3-1/h7-8H,1-4H2
InChIKeyLHMLQNAGBIXGMS-UHFFFAOYSA-N
XLogP0.53
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine
CID 69251990
2,3,4,7-tetrahydro-1H-indazole
CID 173071838
6-methyl-2,3,4,5-tetrahydro-1H-indazole
CID 143902113
3,4,5,6-tetrahydro-2H-cyclopenta[d][1,2]oxazole
CID 163739592
(1Z)-bicyclo[10.8.0]icos-1(12)-ene
CID 5377998
1,2,3,4,5,6-hexahydropyrrolo[3,4-c]pyrrole;hydrobromide
CID 146013756
3-cyclohexyl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-2,4-dione
CID 139692425
tricyclo[6.2.1.02,6]undec-2(6)-ene
CID 12898252
ethane;2,5,6,7-tetrahydro-1H-cyclopenta[c]pyridine
CID 177053758
2,5,6,7-tetrahydro-1H-cyclopenta[c]pyridin-4-amine
CID 175101553
1-cyclopentylidene-5-methylidenecyclononane
CID 162212680
(8aS)-1-cyclobutylidene-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-4-one
CID 70296352

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole?
The IUPAC name of 1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole (CID 154262601) is 1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole.
What is the SMILES notation for 1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole?
The canonical SMILES for 1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole is C1CC2=C(C1)NNC2.
What is the InChIKey of 1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole?
The InChIKey is LHMLQNAGBIXGMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-2-5-4-7-8-6(5)3-1/h7-8H,1-4H2.
What are the key properties of 1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole?
1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole has a molecular weight of 110.16 g/mol, XLogP of 0.53, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,6-hexahydrocyclopenta[c]pyrazole is sourced from PubChem (CID 154262601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).