5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine

C18H24N8 — CID 175343493

IUPAC5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine
SMILESCC(C)Nc1cc(-n2cccn2)ncc1-n1cc(C2CCNCC2)nn1
InChIInChI=1S/C18H24N8/c1-13(2)22-15-10-18(25-9-3-6-21-25)20-11-17(15)26-12-16(23-24-26)14-4-7-19-8-5-14/h3,6,9-14,19H,4-5,7-8H2,1-2H3,(H,20,22)
InChIKeyCLJHINAQUUULSM-UHFFFAOYSA-N
MW352.45 g/mol
LogP2.14
Rot. Bonds5

About 5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine

5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine (PubChem CID 175343493) has the molecular formula C18H24N8 and a molecular weight of 352.45 g/mol. Its IUPAC name is 5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine.

Molecular Properties

Compound Name5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine
PubChem CID175343493
Molecular FormulaC18H24N8
Molecular Weight352.45 g/mol
Exact Mass352.21
IUPAC Name5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine
SMILESCC(C)Nc1cc(-n2cccn2)ncc1-n1cc(C2CCNCC2)nn1
InChIInChI=1S/C18H24N8/c1-13(2)22-15-10-18(25-9-3-6-21-25)20-11-17(15)26-12-16(23-24-26)14-4-7-19-8-5-14/h3,6,9-14,19H,4-5,7-8H2,1-2H3,(H,20,22)
InChIKeyCLJHINAQUUULSM-UHFFFAOYSA-N
XLogP2.14
TPSA85.48 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.45
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine?
The IUPAC name of 5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine (CID 175343493) is 5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine.
What is the SMILES notation for 5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine?
The canonical SMILES for 5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine is CC(C)Nc1cc(-n2cccn2)ncc1-n1cc(C2CCNCC2)nn1.
What is the InChIKey of 5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine?
The InChIKey is CLJHINAQUUULSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N8/c1-13(2)22-15-10-18(25-9-3-6-21-25)20-11-17(15)26-12-16(23-24-26)14-4-7-19-8-5-14/h3,6,9-14,19H,4-5,7-8H2,1-2H3,(H,20,22).
What are the key properties of 5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine?
5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine has a molecular weight of 352.45 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-piperidin-4-yltriazol-1-yl)-N-propan-2-yl-2-pyrazol-1-ylpyridin-4-amine is sourced from PubChem (CID 175343493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).