7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine

C8H17N3 — CID 170905784

IUPAC7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine
SMILESCC1(C)CNCC2CNNC21
InChIInChI=1S/C8H17N3/c1-8(2)5-9-3-6-4-10-11-7(6)8/h6-7,9-11H,3-5H2,1-2H3
InChIKeyWCDCMSOOGHNFPT-UHFFFAOYSA-N
MW155.25 g/mol
LogP-0.29
Rot. Bonds

About 7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine

7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine (PubChem CID 170905784) has the molecular formula C8H17N3 and a molecular weight of 155.25 g/mol. Its IUPAC name is 7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine
PubChem CID170905784
Molecular FormulaC8H17N3
Molecular Weight155.25 g/mol
Exact Mass155.14
IUPAC Name7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine
SMILESCC1(C)CNCC2CNNC21
InChIInChI=1S/C8H17N3/c1-8(2)5-9-3-6-4-10-11-7(6)8/h6-7,9-11H,3-5H2,1-2H3
InChIKeyWCDCMSOOGHNFPT-UHFFFAOYSA-N
XLogP-0.29
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.25
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine?
The IUPAC name of 7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine (CID 170905784) is 7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine.
What is the SMILES notation for 7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine?
The canonical SMILES for 7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine is CC1(C)CNCC2CNNC21.
What is the InChIKey of 7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine?
The InChIKey is WCDCMSOOGHNFPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3/c1-8(2)5-9-3-6-4-10-11-7(6)8/h6-7,9-11H,3-5H2,1-2H3.
What are the key properties of 7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine?
7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine has a molecular weight of 155.25 g/mol, XLogP of -0.29, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-1,2,3,3a,4,5,6,7a-octahydropyrazolo[4,3-c]pyridine is sourced from PubChem (CID 170905784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).