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

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Related Compounds

Dorsomorphin
CID 11524144
4-[6-[4-(1-Methylethoxy)phenyl]pyrazolo[1,5-a]pyrimidin-3-yl]quinoline
CID 50997747
4-[2-[4-(3-Pyridin-4-ylpyrazolo[1,5-a]pyrimidin-6-yl)phenoxy]ethyl]morpholine
CID 5329453
3-(4-Methoxy-3-Methylphenyl)-1-(Piperidin-4-Ylmethyl)-1h-Pyrazolo[3,4-D]pyrimidin-4-Amine
CID 56835771
3-Methoxy-4-hydroxybenzaldehyde [1-(phenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]hydrazone
CID 3805075
6-(4-Methoxy-phenyl)-3-phenyl-pyrazolo[1,5-a]pyrimidine
CID 5329337
3-(6-{4-[2-(Piperidin-1-yl)ethoxy]phenyl}pyrazolo[1,5-a]pyrimidin-3-yl)pyridine
CID 5329452
6-(4-Methoxyphenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyrimidine
CID 5329457
6-(4-Methoxyphenyl)-3-(pyridin-3-yl)pyrazolo[1,5-a]pyrimidine
CID 5329458
Pyrazolo[1,5-b]pyridazine deriv. 70
CID 6539412
N-(3-methoxyphenyl)-1-methyl-6-(4-methylpiperazin-1-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 16456451
ML347
CID 44577753

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).