N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide

C20H24N4O — CID 158274017

IUPACN-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide
SMILESO=C(Nc1nc2cccc(C3=CCC4(CCCC4)CC3)n2n1)C1CC1
InChIInChI=1S/C20H24N4O/c25-18(15-6-7-15)22-19-21-17-5-3-4-16(24(17)23-19)14-8-12-20(13-9-14)10-1-2-11-20/h3-5,8,15H,1-2,6-7,9-13H2,(H,22,23,25)
InChIKeyNYGLIJNINUKMMQ-UHFFFAOYSA-N
MW336.44 g/mol
LogP4.21
Rot. Bonds3

About N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide

N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide (PubChem CID 158274017) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide
PubChem CID158274017
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC NameN-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide
SMILESO=C(Nc1nc2cccc(C3=CCC4(CCCC4)CC3)n2n1)C1CC1
InChIInChI=1S/C20H24N4O/c25-18(15-6-7-15)22-19-21-17-5-3-4-16(24(17)23-19)14-8-12-20(13-9-14)10-1-2-11-20/h3-5,8,15H,1-2,6-7,9-13H2,(H,22,23,25)
InChIKeyNYGLIJNINUKMMQ-UHFFFAOYSA-N
XLogP4.21
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide?
The IUPAC name of N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide (CID 158274017) is N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide is O=C(Nc1nc2cccc(C3=CCC4(CCCC4)CC3)n2n1)C1CC1.
What is the InChIKey of N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide?
The InChIKey is NYGLIJNINUKMMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c25-18(15-6-7-15)22-19-21-17-5-3-4-16(24(17)23-19)14-8-12-20(13-9-14)10-1-2-11-20/h3-5,8,15H,1-2,6-7,9-13H2,(H,22,23,25).
What are the key properties of N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide?
N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide has a molecular weight of 336.44 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-spiro[4.5]dec-8-en-8-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide is sourced from PubChem (CID 158274017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).