(2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone

C14H18N4O — CID 103806814

IUPAC(2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
SMILESCC1CNCC(C)N1C(=O)c1cnn2ccccc12
InChIInChI=1S/C14H18N4O/c1-10-7-15-8-11(2)18(10)14(19)12-9-16-17-6-4-3-5-13(12)17/h3-6,9-11,15H,7-8H2,1-2H3
InChIKeyCUMUBXVXZROFJA-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.16
Rot. Bonds1

About (2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone

(2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone (PubChem CID 103806814) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is (2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone.

Molecular Properties

Compound Name(2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
PubChem CID103806814
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name(2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
SMILESCC1CNCC(C)N1C(=O)c1cnn2ccccc12
InChIInChI=1S/C14H18N4O/c1-10-7-15-8-11(2)18(10)14(19)12-9-16-17-6-4-3-5-13(12)17/h3-6,9-11,15H,7-8H2,1-2H3
InChIKeyCUMUBXVXZROFJA-UHFFFAOYSA-N
XLogP1.16
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone;hydrochloride
CID 119470274
[2-(aminomethyl)-6-methylpiperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 103120796
N-(5-methylpiperidin-3-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 107585040
(2,6-dimethylpiperazin-1-yl)-(2-hydroxyphenyl)methanone
CID 63911393
7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-7-azabicyclo[2.2.1]heptane-2-carboxylic acid
CID 103116928
(3-amino-5-methylpiperidin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 103120978
1,4-diazepan-1-yl(pyrazolo[1,5-a]pyridin-3-yl)methanone;hydrochloride
CID 119414481
3-methyl-1-(pyrazolo[1,5-a]pyridine-3-carbonyl)pyrrolidine-2-carboxylic acid
CID 103117258
N-[(4-hydroxypyrrolidin-3-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide;hydrochloride
CID 120947622
(2,6-dimethylpiperazin-1-yl)-naphthalen-1-ylmethanone
CID 63910984
(2,6-dimethylpiperazin-1-yl)-(2-methylsulfanylphenyl)methanone
CID 79217052
5-methyl-1-(4-methylphenyl)-4-(pyrazolo[1,5-a]pyridine-3-carbonyl)piperazin-2-one
CID 70751338

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The IUPAC name of (2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone (CID 103806814) is (2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone.
What is the SMILES notation for (2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The canonical SMILES for (2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone is CC1CNCC(C)N1C(=O)c1cnn2ccccc12.
What is the InChIKey of (2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The InChIKey is CUMUBXVXZROFJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-10-7-15-8-11(2)18(10)14(19)12-9-16-17-6-4-3-5-13(12)17/h3-6,9-11,15H,7-8H2,1-2H3.
What are the key properties of (2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone?
(2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone has a molecular weight of 258.32 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone is sourced from PubChem (CID 103806814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).