4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol

C22H21N3O — CID 162644575

IUPAC4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESCc1nc2cnc(-c3cccc(C(C)C)c3)cn2c1-c1ccc(O)cc1
InChIInChI=1S/C22H21N3O/c1-14(2)17-5-4-6-18(11-17)20-13-25-21(12-23-20)24-15(3)22(25)16-7-9-19(26)10-8-16/h4-14,26H,1-3H3
InChIKeyKKUHLZANWVMBKD-UHFFFAOYSA-N
MW343.43 g/mol
LogP5.20
Rot. Bonds3

About 4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol

4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol (PubChem CID 162644575) has the molecular formula C22H21N3O and a molecular weight of 343.43 g/mol. Its IUPAC name is 4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol.

Molecular Properties

Compound Name4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol
PubChem CID162644575
Molecular FormulaC22H21N3O
Molecular Weight343.43 g/mol
Exact Mass343.17
IUPAC Name4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESCc1nc2cnc(-c3cccc(C(C)C)c3)cn2c1-c1ccc(O)cc1
InChIInChI=1S/C22H21N3O/c1-14(2)17-5-4-6-18(11-17)20-13-25-21(12-23-20)24-15(3)22(25)16-7-9-19(26)10-8-16/h4-14,26H,1-3H3
InChIKeyKKUHLZANWVMBKD-UHFFFAOYSA-N
XLogP5.20
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.43
LogP ≤ 55.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol 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 4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The IUPAC name of 4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol (CID 162644575) is 4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol.
What is the SMILES notation for 4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The canonical SMILES for 4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol is Cc1nc2cnc(-c3cccc(C(C)C)c3)cn2c1-c1ccc(O)cc1.
What is the InChIKey of 4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The InChIKey is KKUHLZANWVMBKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O/c1-14(2)17-5-4-6-18(11-17)20-13-25-21(12-23-20)24-15(3)22(25)16-7-9-19(26)10-8-16/h4-14,26H,1-3H3.
What are the key properties of 4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol?
4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol has a molecular weight of 343.43 g/mol, XLogP of 5.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-methyl-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]phenol is sourced from PubChem (CID 162644575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).