2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one

C12H14N2O — CID 112713205

IUPAC2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one
SMILESCc1ccn2ncc(C(=O)C(C)C)c2c1
InChIInChI=1S/C12H14N2O/c1-8(2)12(15)10-7-13-14-5-4-9(3)6-11(10)14/h4-8H,1-3H3
InChIKeyZKNIOFAZBMKSJM-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.48
Rot. Bonds2

About 2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one

2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one (PubChem CID 112713205) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one.

Molecular Properties

Compound Name2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one
PubChem CID112713205
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one
SMILESCc1ccn2ncc(C(=O)C(C)C)c2c1
InChIInChI=1S/C12H14N2O/c1-8(2)12(15)10-7-13-14-5-4-9(3)6-11(10)14/h4-8H,1-3H3
InChIKeyZKNIOFAZBMKSJM-UHFFFAOYSA-N
XLogP2.48
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one?
The IUPAC name of 2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one (CID 112713205) is 2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one.
What is the SMILES notation for 2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one?
The canonical SMILES for 2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one is Cc1ccn2ncc(C(=O)C(C)C)c2c1.
What is the InChIKey of 2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one?
The InChIKey is ZKNIOFAZBMKSJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-8(2)12(15)10-7-13-14-5-4-9(3)6-11(10)14/h4-8H,1-3H3.
What are the key properties of 2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one?
2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one has a molecular weight of 202.26 g/mol, XLogP of 2.48, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(5-methylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one is sourced from PubChem (CID 112713205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).