4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol

C17H15N5O — CID 162666173

IUPAC4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESCc1n[nH]c(C)c1-c1cn2c(-c3ccc(O)cc3)cnc2cn1
InChIInChI=1S/C17H15N5O/c1-10-17(11(2)21-20-10)14-9-22-15(7-19-16(22)8-18-14)12-3-5-13(23)6-4-12/h3-9,23H,1-2H3,(H,20,21)
InChIKeySUHGSEKHKIHDNL-UHFFFAOYSA-N
MW305.34 g/mol
LogP3.11
Rot. Bonds2

About 4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol

4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol (PubChem CID 162666173) has the molecular formula C17H15N5O and a molecular weight of 305.34 g/mol. Its IUPAC name is 4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol.

Molecular Properties

Compound Name4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol
PubChem CID162666173
Molecular FormulaC17H15N5O
Molecular Weight305.34 g/mol
Exact Mass305.13
IUPAC Name4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESCc1n[nH]c(C)c1-c1cn2c(-c3ccc(O)cc3)cnc2cn1
InChIInChI=1S/C17H15N5O/c1-10-17(11(2)21-20-10)14-9-22-15(7-19-16(22)8-18-14)12-3-5-13(23)6-4-12/h3-9,23H,1-2H3,(H,20,21)
InChIKeySUHGSEKHKIHDNL-UHFFFAOYSA-N
XLogP3.11
TPSA79.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The IUPAC name of 4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol (CID 162666173) is 4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol.
What is the SMILES notation for 4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The canonical SMILES for 4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol is Cc1n[nH]c(C)c1-c1cn2c(-c3ccc(O)cc3)cnc2cn1.
What is the InChIKey of 4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
The InChIKey is SUHGSEKHKIHDNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O/c1-10-17(11(2)21-20-10)14-9-22-15(7-19-16(22)8-18-14)12-3-5-13(23)6-4-12/h3-9,23H,1-2H3,(H,20,21).
What are the key properties of 4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol?
4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol has a molecular weight of 305.34 g/mol, XLogP of 3.11, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(3,5-dimethyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]phenol is sourced from PubChem (CID 162666173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).