4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol

C17H15N3O — CID 645169

IUPAC4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol
SMILESCc1cc2n(n1)C(c1ccc(O)cc1)Nc1ccccc1-2
InChIInChI=1S/C17H15N3O/c1-11-10-16-14-4-2-3-5-15(14)18-17(20(16)19-11)12-6-8-13(21)9-7-12/h2-10,17-18,21H,1H3
InChIKeyCKGOKJIATFRGOS-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.54
Rot. Bonds1

About 4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol

4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol (PubChem CID 645169) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol.

Molecular Properties

Compound Name4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol
PubChem CID645169
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol
SMILESCc1cc2n(n1)C(c1ccc(O)cc1)Nc1ccccc1-2
InChIInChI=1S/C17H15N3O/c1-11-10-16-14-4-2-3-5-15(14)18-17(20(16)19-11)12-6-8-13(21)9-7-12/h2-10,17-18,21H,1H3
InChIKeyCKGOKJIATFRGOS-UHFFFAOYSA-N
XLogP3.54
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol?
The IUPAC name of 4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol (CID 645169) is 4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol.
What is the SMILES notation for 4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol?
The canonical SMILES for 4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol is Cc1cc2n(n1)C(c1ccc(O)cc1)Nc1ccccc1-2.
What is the InChIKey of 4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol?
The InChIKey is CKGOKJIATFRGOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-11-10-16-14-4-2-3-5-15(14)18-17(20(16)19-11)12-6-8-13(21)9-7-12/h2-10,17-18,21H,1H3.
What are the key properties of 4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol?
4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol has a molecular weight of 277.33 g/mol, XLogP of 3.54, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methyl-5,6-dihydropyrazolo[1,5-c]quinazolin-5-yl)phenol is sourced from PubChem (CID 645169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).