N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide

C16H19N5O2 — CID 166297885

IUPACN-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide
SMILESCc1ccn2cnnc2c1NC(=O)C1CNC(=O)CC12CCC2
InChIInChI=1S/C16H19N5O2/c1-10-3-6-21-9-18-20-14(21)13(10)19-15(23)11-8-17-12(22)7-16(11)4-2-5-16/h3,6,9,11H,2,4-5,7-8H2,1H3,(H,17,22)(H,19,23)
InChIKeyDTLHHBPTOFMHSG-UHFFFAOYSA-N
MW313.36 g/mol
LogP1.28
Rot. Bonds2

About N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide

N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide (PubChem CID 166297885) has the molecular formula C16H19N5O2 and a molecular weight of 313.36 g/mol. Its IUPAC name is N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide.

Molecular Properties

Compound NameN-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide
PubChem CID166297885
Molecular FormulaC16H19N5O2
Molecular Weight313.36 g/mol
Exact Mass313.15
IUPAC NameN-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide
SMILESCc1ccn2cnnc2c1NC(=O)C1CNC(=O)CC12CCC2
InChIInChI=1S/C16H19N5O2/c1-10-3-6-21-9-18-20-14(21)13(10)19-15(23)11-8-17-12(22)7-16(11)4-2-5-16/h3,6,9,11H,2,4-5,7-8H2,1H3,(H,17,22)(H,19,23)
InChIKeyDTLHHBPTOFMHSG-UHFFFAOYSA-N
XLogP1.28
TPSA88.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide?
The IUPAC name of N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide (CID 166297885) is N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide.
What is the SMILES notation for N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide?
The canonical SMILES for N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide is Cc1ccn2cnnc2c1NC(=O)C1CNC(=O)CC12CCC2.
What is the InChIKey of N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide?
The InChIKey is DTLHHBPTOFMHSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O2/c1-10-3-6-21-9-18-20-14(21)13(10)19-15(23)11-8-17-12(22)7-16(11)4-2-5-16/h3,6,9,11H,2,4-5,7-8H2,1H3,(H,17,22)(H,19,23).
What are the key properties of N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide?
N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 1.28, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-6-oxo-7-azaspiro[3.5]nonane-9-carboxamide is sourced from PubChem (CID 166297885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).