[2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine

C14H21N5 — CID 117133485

IUPAC[2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine
SMILESCC(C)N1CCC(c2nc3cc(CN)ccn3n2)C1
InChIInChI=1S/C14H21N5/c1-10(2)18-5-4-12(9-18)14-16-13-7-11(8-15)3-6-19(13)17-14/h3,6-7,10,12H,4-5,8-9,15H2,1-2H3
InChIKeyRFEPFYJUWWJMME-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.39
Rot. Bonds3

About [2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine

[2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine (PubChem CID 117133485) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is [2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine.

Molecular Properties

Compound Name[2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine
PubChem CID117133485
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name[2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine
SMILESCC(C)N1CCC(c2nc3cc(CN)ccn3n2)C1
InChIInChI=1S/C14H21N5/c1-10(2)18-5-4-12(9-18)14-16-13-7-11(8-15)3-6-19(13)17-14/h3,6-7,10,12H,4-5,8-9,15H2,1-2H3
InChIKeyRFEPFYJUWWJMME-UHFFFAOYSA-N
XLogP1.39
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine
CID 117133557
[2-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine
CID 117133612
2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117128858
[2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine
CID 117129335
methyl 2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
CID 117133589
2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
CID 117134101
[2-(oxolan-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine
CID 117134118
5-chloro-2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117131179
2-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbaldehyde
CID 117133495
7-chloro-2-[(1-propan-2-ylpiperidin-3-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117134724
2-(1-propan-2-ylpiperidin-4-yl)-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
CID 117128935
2-(1-propan-2-ylpyrrolidin-3-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-ol
CID 117156443

Frequently Asked Questions

What is the IUPAC name of [2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine?
The IUPAC name of [2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine (CID 117133485) is [2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine.
What is the SMILES notation for [2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine?
The canonical SMILES for [2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine is CC(C)N1CCC(c2nc3cc(CN)ccn3n2)C1.
What is the InChIKey of [2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine?
The InChIKey is RFEPFYJUWWJMME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-10(2)18-5-4-12(9-18)14-16-13-7-11(8-15)3-6-19(13)17-14/h3,6-7,10,12H,4-5,8-9,15H2,1-2H3.
What are the key properties of [2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine?
[2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine has a molecular weight of 259.36 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-propan-2-ylpyrrolidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanamine is sourced from PubChem (CID 117133485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).