2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine

C6H11N3 — CID 69251990

IUPAC2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine
SMILESC1CC2=C(CN1)CNN2
InChIInChI=1S/C6H11N3/c1-2-7-3-5-4-8-9-6(1)5/h7-9H,1-4H2
InChIKeyVCAYESBDZKWSLC-UHFFFAOYSA-N
MW125.17 g/mol
LogP-0.66
Rot. Bonds

About 2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine

2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine (PubChem CID 69251990) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine
PubChem CID69251990
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine
SMILESC1CC2=C(CN1)CNN2
InChIInChI=1S/C6H11N3/c1-2-7-3-5-4-8-9-6(1)5/h7-9H,1-4H2
InChIKeyVCAYESBDZKWSLC-UHFFFAOYSA-N
XLogP-0.66
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 5-0.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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2-methylidene-4,5,6,7-tetrahydro-1H-[1,3]oxazolo[5,4-c]pyridine
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6-methyl-2,3,4,5-tetrahydro-1H-indazole
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piperidin-3-one;hydrate;hydrobromide
CID 139881606
bis(1,2,3,4-tetrahydroisoquinoline);dihydrobromide
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Frequently Asked Questions

What is the IUPAC name of 2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine (CID 69251990) is 2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine is C1CC2=C(CN1)CNN2.
What is the InChIKey of 2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine?
The InChIKey is VCAYESBDZKWSLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-2-7-3-5-4-8-9-6(1)5/h7-9H,1-4H2.
What are the key properties of 2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine?
2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine has a molecular weight of 125.17 g/mol, XLogP of -0.66, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5,6,7-hexahydro-1H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 69251990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).