3,7-dihydropyrrolo[2,3-h]quinazolin-4-one

C10H7N3O — CID 152522842

IUPAC3,7-dihydropyrrolo[2,3-h]quinazolin-4-one
SMILESO=c1[nH]cnc2c1ccc1[nH]ccc12
InChIInChI=1S/C10H7N3O/c14-10-7-1-2-8-6(3-4-11-8)9(7)12-5-13-10/h1-5,11H,(H,12,13,14)
InChIKeyYHWVRXDPKONMNN-UHFFFAOYSA-N
MW185.19 g/mol
LogP1.40
Rot. Bonds

About 3,7-dihydropyrrolo[2,3-h]quinazolin-4-one

3,7-dihydropyrrolo[2,3-h]quinazolin-4-one (PubChem CID 152522842) has the molecular formula C10H7N3O and a molecular weight of 185.19 g/mol. Its IUPAC name is 3,7-dihydropyrrolo[2,3-h]quinazolin-4-one.

Molecular Properties

Compound Name3,7-dihydropyrrolo[2,3-h]quinazolin-4-one
PubChem CID152522842
Molecular FormulaC10H7N3O
Molecular Weight185.19 g/mol
Exact Mass185.06
IUPAC Name3,7-dihydropyrrolo[2,3-h]quinazolin-4-one
SMILESO=c1[nH]cnc2c1ccc1[nH]ccc12
InChIInChI=1S/C10H7N3O/c14-10-7-1-2-8-6(3-4-11-8)9(7)12-5-13-10/h1-5,11H,(H,12,13,14)
InChIKeyYHWVRXDPKONMNN-UHFFFAOYSA-N
XLogP1.40
TPSA61.54 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.19
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,7-dihydropyrrolo[2,3-h]quinazolin-4-one?
The IUPAC name of 3,7-dihydropyrrolo[2,3-h]quinazolin-4-one (CID 152522842) is 3,7-dihydropyrrolo[2,3-h]quinazolin-4-one.
What is the SMILES notation for 3,7-dihydropyrrolo[2,3-h]quinazolin-4-one?
The canonical SMILES for 3,7-dihydropyrrolo[2,3-h]quinazolin-4-one is O=c1[nH]cnc2c1ccc1[nH]ccc12.
What is the InChIKey of 3,7-dihydropyrrolo[2,3-h]quinazolin-4-one?
The InChIKey is YHWVRXDPKONMNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O/c14-10-7-1-2-8-6(3-4-11-8)9(7)12-5-13-10/h1-5,11H,(H,12,13,14).
What are the key properties of 3,7-dihydropyrrolo[2,3-h]quinazolin-4-one?
3,7-dihydropyrrolo[2,3-h]quinazolin-4-one has a molecular weight of 185.19 g/mol, XLogP of 1.40, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dihydropyrrolo[2,3-h]quinazolin-4-one is sourced from PubChem (CID 152522842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).