1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane

C24H41N5O — CID 142146650

IUPAC1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane
SMILESCC.CC.CC.CC.CCCCC(=O)c1cc(N)n2nc(-c3ccccn3)nc2c1
InChIInChI=1S/C16H17N5O.4C2H6/c1-2-3-7-13(22)11-9-14(17)21-15(10-11)19-16(20-21)12-6-4-5-8-18-12;4*1-2/h4-6,8-10H,2-3,7,17H2,1H3;4*1-2H3
InChIKeyRBVMCMZBNKAEIX-UHFFFAOYSA-N
MW415.63 g/mol
LogP6.85
Rot. Bonds5

About 1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane

1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane (PubChem CID 142146650) has the molecular formula C24H41N5O and a molecular weight of 415.63 g/mol. Its IUPAC name is 1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane.

Molecular Properties

Compound Name1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane
PubChem CID142146650
Molecular FormulaC24H41N5O
Molecular Weight415.63 g/mol
Exact Mass415.33
IUPAC Name1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane
SMILESCC.CC.CC.CC.CCCCC(=O)c1cc(N)n2nc(-c3ccccn3)nc2c1
InChIInChI=1S/C16H17N5O.4C2H6/c1-2-3-7-13(22)11-9-14(17)21-15(10-11)19-16(20-21)12-6-4-5-8-18-12;4*1-2/h4-6,8-10H,2-3,7,17H2,1H3;4*1-2H3
InChIKeyRBVMCMZBNKAEIX-UHFFFAOYSA-N
XLogP6.85
TPSA86.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.63
LogP ≤ 56.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane with MolForge

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Related Compounds

5-amino-N,N-diethyl-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 23552688
7-piperidin-1-yl-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 18681566
ethane;1-phenylpentan-1-one
CID 143728184
octanoic acid;6-pyridin-2-yl-1,3,5-triazine-2,4-diamine
CID 139036969
7-[6-(propan-2-ylamino)-3-pyridinyl]-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-5-amine
CID 18313647
2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-amine
CID 117134890
5-amino-N-butyl-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 11393342
1-pyridin-3-ylpentan-1-one
CID 12648543
1-(2-methyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)-7-phenylheptan-1-one
CID 24948917
acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine
CID 110170704
6-butyl-5-chloro-7-methyl-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
CID 23151509
1-pyridin-2-ylhexan-1-one
CID 556347

Frequently Asked Questions

What is the IUPAC name of 1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane?
The IUPAC name of 1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane (CID 142146650) is 1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane.
What is the SMILES notation for 1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane?
The canonical SMILES for 1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane is CC.CC.CC.CC.CCCCC(=O)c1cc(N)n2nc(-c3ccccn3)nc2c1.
What is the InChIKey of 1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane?
The InChIKey is RBVMCMZBNKAEIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O.4C2H6/c1-2-3-7-13(22)11-9-14(17)21-15(10-11)19-16(20-21)12-6-4-5-8-18-12;4*1-2/h4-6,8-10H,2-3,7,17H2,1H3;4*1-2H3.
What are the key properties of 1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane?
1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane has a molecular weight of 415.63 g/mol, XLogP of 6.85, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-amino-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pentan-1-one;ethane is sourced from PubChem (CID 142146650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).