2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline

C16H13N5 — CID 102626693

IUPAC2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline
SMILESNc1ccccc1-c1cnn(-c2cccc3nccn23)c1
InChIInChI=1S/C16H13N5/c17-14-5-2-1-4-13(14)12-10-19-21(11-12)16-7-3-6-15-18-8-9-20(15)16/h1-11H,17H2
InChIKeyRWCKIZWLHUENGJ-UHFFFAOYSA-N
MW275.31 g/mol
LogP2.77
Rot. Bonds2

About 2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline

2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline (PubChem CID 102626693) has the molecular formula C16H13N5 and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline.

Molecular Properties

Compound Name2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline
PubChem CID102626693
Molecular FormulaC16H13N5
Molecular Weight275.31 g/mol
Exact Mass275.12
IUPAC Name2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline
SMILESNc1ccccc1-c1cnn(-c2cccc3nccn23)c1
InChIInChI=1S/C16H13N5/c17-14-5-2-1-4-13(14)12-10-19-21(11-12)16-7-3-6-15-18-8-9-20(15)16/h1-11H,17H2
InChIKeyRWCKIZWLHUENGJ-UHFFFAOYSA-N
XLogP2.77
TPSA61.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline?
The IUPAC name of 2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline (CID 102626693) is 2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline.
What is the SMILES notation for 2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline?
The canonical SMILES for 2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline is Nc1ccccc1-c1cnn(-c2cccc3nccn23)c1.
What is the InChIKey of 2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline?
The InChIKey is RWCKIZWLHUENGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N5/c17-14-5-2-1-4-13(14)12-10-19-21(11-12)16-7-3-6-15-18-8-9-20(15)16/h1-11H,17H2.
What are the key properties of 2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline?
2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline has a molecular weight of 275.31 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-imidazo[1,2-a]pyridin-5-ylpyrazol-4-yl)aniline is sourced from PubChem (CID 102626693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).