5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C19H26N8 — CID 168799417

IUPAC5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESc1n[nH]cc1-c1ccc2nc(N[C@@H]3CCCNC3)nn2c1N1CCCCC1
InChIInChI=1S/C19H26N8/c1-2-9-26(10-3-1)18-16(14-11-21-22-12-14)6-7-17-24-19(25-27(17)18)23-15-5-4-8-20-13-15/h6-7,11-12,15,20H,1-5,8-10,13H2,(H,21,22)(H,23,25)/t15-/m1/s1
InChIKeyHQMZMFFKQVJVMZ-OAHLLOKOSA-N
MW366.47 g/mol
LogP2.27
Rot. Bonds4

About 5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 168799417) has the molecular formula C19H26N8 and a molecular weight of 366.47 g/mol. Its IUPAC name is 5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID168799417
Molecular FormulaC19H26N8
Molecular Weight366.47 g/mol
Exact Mass366.23
IUPAC Name5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESc1n[nH]cc1-c1ccc2nc(N[C@@H]3CCCNC3)nn2c1N1CCCCC1
InChIInChI=1S/C19H26N8/c1-2-9-26(10-3-1)18-16(14-11-21-22-12-14)6-7-17-24-19(25-27(17)18)23-15-5-4-8-20-13-15/h6-7,11-12,15,20H,1-5,8-10,13H2,(H,21,22)(H,23,25)/t15-/m1/s1
InChIKeyHQMZMFFKQVJVMZ-OAHLLOKOSA-N
XLogP2.27
TPSA86.17 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 52.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 168799417) is 5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is c1n[nH]cc1-c1ccc2nc(N[C@@H]3CCCNC3)nn2c1N1CCCCC1.
What is the InChIKey of 5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is HQMZMFFKQVJVMZ-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H26N8/c1-2-9-26(10-3-1)18-16(14-11-21-22-12-14)6-7-17-24-19(25-27(17)18)23-15-5-4-8-20-13-15/h6-7,11-12,15,20H,1-5,8-10,13H2,(H,21,22)(H,23,25)/t15-/m1/s1.
What are the key properties of 5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 366.47 g/mol, XLogP of 2.27, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-1-yl-N-[(3R)-piperidin-3-yl]-6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 168799417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).