1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol

C16H20N4O2 — CID 75404929

IUPAC1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol
SMILESCOCC(O)CN(C)c1nc2cc(C)nn2c2ccccc12
InChIInChI=1S/C16H20N4O2/c1-11-8-15-17-16(19(2)9-12(21)10-22-3)13-6-4-5-7-14(13)20(15)18-11/h4-8,12,21H,9-10H2,1-3H3
InChIKeyZHYVUIISOQOYSJ-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.63
Rot. Bonds5

About 1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol

1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol (PubChem CID 75404929) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol.

Molecular Properties

Compound Name1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol
PubChem CID75404929
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol
SMILESCOCC(O)CN(C)c1nc2cc(C)nn2c2ccccc12
InChIInChI=1S/C16H20N4O2/c1-11-8-15-17-16(19(2)9-12(21)10-22-3)13-6-4-5-7-14(13)20(15)18-11/h4-8,12,21H,9-10H2,1-3H3
InChIKeyZHYVUIISOQOYSJ-UHFFFAOYSA-N
XLogP1.63
TPSA62.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol?
The IUPAC name of 1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol (CID 75404929) is 1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol.
What is the SMILES notation for 1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol?
The canonical SMILES for 1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol is COCC(O)CN(C)c1nc2cc(C)nn2c2ccccc12.
What is the InChIKey of 1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol?
The InChIKey is ZHYVUIISOQOYSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-11-8-15-17-16(19(2)9-12(21)10-22-3)13-6-4-5-7-14(13)20(15)18-11/h4-8,12,21H,9-10H2,1-3H3.
What are the key properties of 1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol?
1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol has a molecular weight of 300.36 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-[methyl-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)amino]propan-2-ol is sourced from PubChem (CID 75404929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).