7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine

C16H23N5 — CID 65471843

IUPAC7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESCc1cc(NC2CC3CCCC(C2)N3C)n2ncnc2c1
InChIInChI=1S/C16H23N5/c1-11-6-15-17-10-18-21(15)16(7-11)19-12-8-13-4-3-5-14(9-12)20(13)2/h6-7,10,12-14,19H,3-5,8-9H2,1-2H3
InChIKeyAJTSQEGGYYJSPZ-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.46
Rot. Bonds2

About 7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine

7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine (PubChem CID 65471843) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is 7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine.

Molecular Properties

Compound Name7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
PubChem CID65471843
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC Name7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESCc1cc(NC2CC3CCCC(C2)N3C)n2ncnc2c1
InChIInChI=1S/C16H23N5/c1-11-6-15-17-10-18-21(15)16(7-11)19-12-8-13-4-3-5-14(9-12)20(13)2/h6-7,10,12-14,19H,3-5,8-9H2,1-2H3
InChIKeyAJTSQEGGYYJSPZ-UHFFFAOYSA-N
XLogP2.46
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The IUPAC name of 7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine (CID 65471843) is 7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine.
What is the SMILES notation for 7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The canonical SMILES for 7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine is Cc1cc(NC2CC3CCCC(C2)N3C)n2ncnc2c1.
What is the InChIKey of 7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The InChIKey is AJTSQEGGYYJSPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-11-6-15-17-10-18-21(15)16(7-11)19-12-8-13-4-3-5-14(9-12)20(13)2/h6-7,10,12-14,19H,3-5,8-9H2,1-2H3.
What are the key properties of 7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine has a molecular weight of 285.39 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine is sourced from PubChem (CID 65471843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).