4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol

C18H15N5O2 — CID 24864574

IUPAC4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol
SMILESCOc1ccc(Nc2ccn3ncc(-c4ccc(O)cc4)c3n2)cn1
InChIInChI=1S/C18H15N5O2/c1-25-17-7-4-13(10-19-17)21-16-8-9-23-18(22-16)15(11-20-23)12-2-5-14(24)6-3-12/h2-11,24H,1H3,(H,21,22)
InChIKeyHSBWJCROZYXNLJ-UHFFFAOYSA-N
MW333.35 g/mol
LogP3.25
Rot. Bonds4

About 4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol

4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol (PubChem CID 24864574) has the molecular formula C18H15N5O2 and a molecular weight of 333.35 g/mol. Its IUPAC name is 4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol.

Molecular Properties

Compound Name4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol
PubChem CID24864574
Molecular FormulaC18H15N5O2
Molecular Weight333.35 g/mol
Exact Mass333.12
IUPAC Name4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol
SMILESCOc1ccc(Nc2ccn3ncc(-c4ccc(O)cc4)c3n2)cn1
InChIInChI=1S/C18H15N5O2/c1-25-17-7-4-13(10-19-17)21-16-8-9-23-18(22-16)15(11-20-23)12-2-5-14(24)6-3-12/h2-11,24H,1H3,(H,21,22)
InChIKeyHSBWJCROZYXNLJ-UHFFFAOYSA-N
XLogP3.25
TPSA84.57 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.35
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-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-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol?
The IUPAC name of 4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol (CID 24864574) is 4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol.
What is the SMILES notation for 4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol?
The canonical SMILES for 4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol is COc1ccc(Nc2ccn3ncc(-c4ccc(O)cc4)c3n2)cn1.
What is the InChIKey of 4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol?
The InChIKey is HSBWJCROZYXNLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O2/c1-25-17-7-4-13(10-19-17)21-16-8-9-23-18(22-16)15(11-20-23)12-2-5-14(24)6-3-12/h2-11,24H,1H3,(H,21,22).
What are the key properties of 4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol?
4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol has a molecular weight of 333.35 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol is sourced from PubChem (CID 24864574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).