2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one

C15H15N5O2 — CID 174168140

IUPAC2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one
SMILESC=C1NC(=O)C2(CCN(C(=O)c3cnn4ccccc34)C2)N1
InChIInChI=1S/C15H15N5O2/c1-10-17-14(22)15(18-10)5-7-19(9-15)13(21)11-8-16-20-6-3-2-4-12(11)20/h2-4,6,8,18H,1,5,7,9H2,(H,17,22)
InChIKeyGKQXNMNJCQASKS-UHFFFAOYSA-N
MW297.32 g/mol
LogP0.11
Rot. Bonds1

About 2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one

2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one (PubChem CID 174168140) has the molecular formula C15H15N5O2 and a molecular weight of 297.32 g/mol. Its IUPAC name is 2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one.

Molecular Properties

Compound Name2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one
PubChem CID174168140
Molecular FormulaC15H15N5O2
Molecular Weight297.32 g/mol
Exact Mass297.12
IUPAC Name2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one
SMILESC=C1NC(=O)C2(CCN(C(=O)c3cnn4ccccc34)C2)N1
InChIInChI=1S/C15H15N5O2/c1-10-17-14(22)15(18-10)5-7-19(9-15)13(21)11-8-16-20-6-3-2-4-12(11)20/h2-4,6,8,18H,1,5,7,9H2,(H,17,22)
InChIKeyGKQXNMNJCQASKS-UHFFFAOYSA-N
XLogP0.11
TPSA78.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(3-hydroxy-3-methylpyrrolidin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 103726815
[(3R)-3-[(dimethylamino)methyl]-3-hydroxypyrrolidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 95713243
1-(pyrazolo[1,5-a]pyridine-3-carbonyl)piperidin-3-one
CID 103118159
1,4-diazepan-1-yl(pyrazolo[1,5-a]pyridin-3-yl)methanone;hydrochloride
CID 119414481
(3-hydroxy-3-propan-2-ylazetidin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 103120226
7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-2-(pyridin-2-ylmethyl)-2,7-diazaspiro[4.4]nonan-1-one
CID 175641918
pyrazolo[1,5-a]pyridin-3-yl-[2-(2H-tetrazol-5-yl)-6-azaspiro[2.5]octan-6-yl]methanone
CID 166313550
(3-amino-5-methylpiperidin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 103120978
2-methylidene-7-(2-methylpropanoyl)-1,3,7-triazaspiro[4.4]nonan-4-one
CID 122675593
8a-benzyl-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,5,6,8-tetrahydro-[1,3]oxazolo[3,4-a]pyrazin-3-one
CID 146038513
[(3S)-3-hydroxypiperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 107224385
(4-benzhydrylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 20875663

Frequently Asked Questions

What is the IUPAC name of 2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one?
The IUPAC name of 2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one (CID 174168140) is 2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one.
What is the SMILES notation for 2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one?
The canonical SMILES for 2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one is C=C1NC(=O)C2(CCN(C(=O)c3cnn4ccccc34)C2)N1.
What is the InChIKey of 2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one?
The InChIKey is GKQXNMNJCQASKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2/c1-10-17-14(22)15(18-10)5-7-19(9-15)13(21)11-8-16-20-6-3-2-4-12(11)20/h2-4,6,8,18H,1,5,7,9H2,(H,17,22).
What are the key properties of 2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one?
2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one has a molecular weight of 297.32 g/mol, XLogP of 0.11, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-7-(pyrazolo[1,5-a]pyridine-3-carbonyl)-1,3,7-triazaspiro[4.4]nonan-4-one is sourced from PubChem (CID 174168140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).