9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol

C11H13N3O — CID 24837261

IUPAC9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol
SMILESNC1c2ccccc2N=C2CCC(O)N21
InChIInChI=1S/C11H13N3O/c12-11-7-3-1-2-4-8(7)13-9-5-6-10(15)14(9)11/h1-4,10-11,15H,5-6,12H2
InChIKeyBMWGSCZLKUUIHW-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.10
Rot. Bonds

About 9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol

9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol (PubChem CID 24837261) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol.

Molecular Properties

Compound Name9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol
PubChem CID24837261
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol
SMILESNC1c2ccccc2N=C2CCC(O)N21
InChIInChI=1S/C11H13N3O/c12-11-7-3-1-2-4-8(7)13-9-5-6-10(15)14(9)11/h1-4,10-11,15H,5-6,12H2
InChIKeyBMWGSCZLKUUIHW-UHFFFAOYSA-N
XLogP1.10
TPSA61.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol?
The IUPAC name of 9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol (CID 24837261) is 9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol.
What is the SMILES notation for 9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol?
The canonical SMILES for 9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol is NC1c2ccccc2N=C2CCC(O)N21.
What is the InChIKey of 9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol?
The InChIKey is BMWGSCZLKUUIHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c12-11-7-3-1-2-4-8(7)13-9-5-6-10(15)14(9)11/h1-4,10-11,15H,5-6,12H2.
What are the key properties of 9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol?
9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol has a molecular weight of 203.25 g/mol, XLogP of 1.10, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-amino-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-1-ol is sourced from PubChem (CID 24837261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).