[3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol

C18H15N5O — CID 122429884

IUPAC[3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol
SMILESOCc1cccc(Nc2nccc(-c3cnc4ccccn34)n2)c1
InChIInChI=1S/C18H15N5O/c24-12-13-4-3-5-14(10-13)21-18-19-8-7-15(22-18)16-11-20-17-6-1-2-9-23(16)17/h1-11,24H,12H2,(H,19,21,22)
InChIKeyAKIGSCXPWVCCMK-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.03
Rot. Bonds4

About [3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol

[3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol (PubChem CID 122429884) has the molecular formula C18H15N5O and a molecular weight of 317.35 g/mol. Its IUPAC name is [3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol.

Molecular Properties

Compound Name[3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol
PubChem CID122429884
Molecular FormulaC18H15N5O
Molecular Weight317.35 g/mol
Exact Mass317.13
IUPAC Name[3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol
SMILESOCc1cccc(Nc2nccc(-c3cnc4ccccn34)n2)c1
InChIInChI=1S/C18H15N5O/c24-12-13-4-3-5-14(10-13)21-18-19-8-7-15(22-18)16-11-20-17-6-1-2-9-23(16)17/h1-11,24H,12H2,(H,19,21,22)
InChIKeyAKIGSCXPWVCCMK-UHFFFAOYSA-N
XLogP3.03
TPSA75.34 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze [3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol 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 [3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol?
The IUPAC name of [3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol (CID 122429884) is [3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol.
What is the SMILES notation for [3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol?
The canonical SMILES for [3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol is OCc1cccc(Nc2nccc(-c3cnc4ccccn34)n2)c1.
What is the InChIKey of [3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol?
The InChIKey is AKIGSCXPWVCCMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O/c24-12-13-4-3-5-14(10-13)21-18-19-8-7-15(22-18)16-11-20-17-6-1-2-9-23(16)17/h1-11,24H,12H2,(H,19,21,22).
What are the key properties of [3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol?
[3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol has a molecular weight of 317.35 g/mol, XLogP of 3.03, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]phenyl]methanol is sourced from PubChem (CID 122429884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).