2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine

C13H18N2 — CID 59525160

IUPAC2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine
SMILESC=C(C1=C2C=CC=CN2NC1C)C(C)C
InChIInChI=1S/C13H18N2/c1-9(2)10(3)13-11(4)14-15-8-6-5-7-12(13)15/h5-9,11,14H,3H2,1-2,4H3
InChIKeyRSFHSJLFOWQEAH-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.74
Rot. Bonds2

About 2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine

2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine (PubChem CID 59525160) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine
PubChem CID59525160
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine
SMILESC=C(C1=C2C=CC=CN2NC1C)C(C)C
InChIInChI=1S/C13H18N2/c1-9(2)10(3)13-11(4)14-15-8-6-5-7-12(13)15/h5-9,11,14H,3H2,1-2,4H3
InChIKeyRSFHSJLFOWQEAH-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine?
The IUPAC name of 2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine (CID 59525160) is 2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine.
What is the SMILES notation for 2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine?
The canonical SMILES for 2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine is C=C(C1=C2C=CC=CN2NC1C)C(C)C.
What is the InChIKey of 2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine?
The InChIKey is RSFHSJLFOWQEAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-9(2)10(3)13-11(4)14-15-8-6-5-7-12(13)15/h5-9,11,14H,3H2,1-2,4H3.
What are the key properties of 2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine?
2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine has a molecular weight of 202.30 g/mol, XLogP of 2.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(3-methylbut-1-en-2-yl)-1,2-dihydropyrazolo[1,5-a]pyridine is sourced from PubChem (CID 59525160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).