3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine

C9H12N2 — CID 58047454

IUPAC3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine
SMILESCC1=CC2C(C)=CNN2C=C1
InChIInChI=1S/C9H12N2/c1-7-3-4-11-9(5-7)8(2)6-10-11/h3-6,9-10H,1-2H3
InChIKeyMOXRRLKRYYQHLK-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.55
Rot. Bonds

About 3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine

3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine (PubChem CID 58047454) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine
PubChem CID58047454
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine
SMILESCC1=CC2C(C)=CNN2C=C1
InChIInChI=1S/C9H12N2/c1-7-3-4-11-9(5-7)8(2)6-10-11/h3-6,9-10H,1-2H3
InChIKeyMOXRRLKRYYQHLK-UHFFFAOYSA-N
XLogP1.55
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine?
The IUPAC name of 3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine (CID 58047454) is 3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine.
What is the SMILES notation for 3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine?
The canonical SMILES for 3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine is CC1=CC2C(C)=CNN2C=C1.
What is the InChIKey of 3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine?
The InChIKey is MOXRRLKRYYQHLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-7-3-4-11-9(5-7)8(2)6-10-11/h3-6,9-10H,1-2H3.
What are the key properties of 3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine?
3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine has a molecular weight of 148.21 g/mol, XLogP of 1.55, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine is sourced from PubChem (CID 58047454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).