1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol

C16H18N4O — CID 34044694

IUPAC1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol
SMILESCc1cc2nc(N3CCC(O)CC3)c3ccccc3n2n1
InChIInChI=1S/C16H18N4O/c1-11-10-15-17-16(19-8-6-12(21)7-9-19)13-4-2-3-5-14(13)20(15)18-11/h2-5,10,12,21H,6-9H2,1H3
InChIKeyGRKNPXBYYIIWPY-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.15
Rot. Bonds1

About 1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol

1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol (PubChem CID 34044694) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol.

Molecular Properties

Compound Name1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol
PubChem CID34044694
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol
SMILESCc1cc2nc(N3CCC(O)CC3)c3ccccc3n2n1
InChIInChI=1S/C16H18N4O/c1-11-10-15-17-16(19-8-6-12(21)7-9-19)13-4-2-3-5-14(13)20(15)18-11/h2-5,10,12,21H,6-9H2,1H3
InChIKeyGRKNPXBYYIIWPY-UHFFFAOYSA-N
XLogP2.15
TPSA53.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol?
The IUPAC name of 1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol (CID 34044694) is 1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol.
What is the SMILES notation for 1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol?
The canonical SMILES for 1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol is Cc1cc2nc(N3CCC(O)CC3)c3ccccc3n2n1.
What is the InChIKey of 1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol?
The InChIKey is GRKNPXBYYIIWPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-11-10-15-17-16(19-8-6-12(21)7-9-19)13-4-2-3-5-14(13)20(15)18-11/h2-5,10,12,21H,6-9H2,1H3.
What are the key properties of 1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol?
1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol has a molecular weight of 282.35 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)piperidin-4-ol is sourced from PubChem (CID 34044694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).