3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine

C16H20N4 — CID 74235381

IUPAC3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESCc1cccc(CN2CCc3[nH]nc(C4CC4)c3C2)n1
InChIInChI=1S/C16H20N4/c1-11-3-2-4-13(17-11)9-20-8-7-15-14(10-20)16(19-18-15)12-5-6-12/h2-4,12H,5-10H2,1H3,(H,18,19)
InChIKeyIGWFJAGJBCHIOD-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.55
Rot. Bonds3

About 3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine

3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine (PubChem CID 74235381) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
PubChem CID74235381
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESCc1cccc(CN2CCc3[nH]nc(C4CC4)c3C2)n1
InChIInChI=1S/C16H20N4/c1-11-3-2-4-13(17-11)9-20-8-7-15-14(10-20)16(19-18-15)12-5-6-12/h2-4,12H,5-10H2,1H3,(H,18,19)
InChIKeyIGWFJAGJBCHIOD-UHFFFAOYSA-N
XLogP2.55
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The IUPAC name of 3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine (CID 74235381) is 3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine is Cc1cccc(CN2CCc3[nH]nc(C4CC4)c3C2)n1.
What is the InChIKey of 3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The InChIKey is IGWFJAGJBCHIOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-11-3-2-4-13(17-11)9-20-8-7-15-14(10-20)16(19-18-15)12-5-6-12/h2-4,12H,5-10H2,1H3,(H,18,19).
What are the key properties of 3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine has a molecular weight of 268.36 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-[(6-methyl-2-pyridinyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine is sourced from PubChem (CID 74235381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).