3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine

C13H21N3 — CID 83849486

IUPAC3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine
SMILESCn1nc(C2CCCCC2)c2c1CNCC2
InChIInChI=1S/C13H21N3/c1-16-12-9-14-8-7-11(12)13(15-16)10-5-3-2-4-6-10/h10,14H,2-9H2,1H3
InChIKeyCZSQOJCYYGZSLV-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.11
Rot. Bonds1

About 3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine

3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine (PubChem CID 83849486) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine.

Molecular Properties

Compound Name3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine
PubChem CID83849486
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine
SMILESCn1nc(C2CCCCC2)c2c1CNCC2
InChIInChI=1S/C13H21N3/c1-16-12-9-14-8-7-11(12)13(15-16)10-5-3-2-4-6-10/h10,14H,2-9H2,1H3
InChIKeyCZSQOJCYYGZSLV-UHFFFAOYSA-N
XLogP2.11
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine?
The IUPAC name of 3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine (CID 83849486) is 3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine.
What is the SMILES notation for 3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine?
The canonical SMILES for 3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine is Cn1nc(C2CCCCC2)c2c1CNCC2.
What is the InChIKey of 3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine?
The InChIKey is CZSQOJCYYGZSLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-16-12-9-14-8-7-11(12)13(15-16)10-5-3-2-4-6-10/h10,14H,2-9H2,1H3.
What are the key properties of 3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine?
3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine has a molecular weight of 219.33 g/mol, XLogP of 2.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-1-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine is sourced from PubChem (CID 83849486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).