3,5-dihydroindeno[1,2-d]pyrimidin-4-one

C11H8N2O — CID 135433734

IUPAC3,5-dihydroindeno[1,2-d]pyrimidin-4-one
SMILESO=c1[nH]cnc2c1Cc1ccccc1-2
InChIInChI=1S/C11H8N2O/c14-11-9-5-7-3-1-2-4-8(7)10(9)12-6-13-11/h1-4,6H,5H2,(H,12,13,14)
InChIKeyMZXWRSBOVARRRS-UHFFFAOYSA-N
MW184.20 g/mol
LogP1.34
Rot. Bonds

About 3,5-dihydroindeno[1,2-d]pyrimidin-4-one

3,5-dihydroindeno[1,2-d]pyrimidin-4-one (PubChem CID 135433734) has the molecular formula C11H8N2O and a molecular weight of 184.20 g/mol. Its IUPAC name is 3,5-dihydroindeno[1,2-d]pyrimidin-4-one.

Molecular Properties

Compound Name3,5-dihydroindeno[1,2-d]pyrimidin-4-one
PubChem CID135433734
Molecular FormulaC11H8N2O
Molecular Weight184.20 g/mol
Exact Mass184.06
IUPAC Name3,5-dihydroindeno[1,2-d]pyrimidin-4-one
SMILESO=c1[nH]cnc2c1Cc1ccccc1-2
InChIInChI=1S/C11H8N2O/c14-11-9-5-7-3-1-2-4-8(7)10(9)12-6-13-11/h1-4,6H,5H2,(H,12,13,14)
InChIKeyMZXWRSBOVARRRS-UHFFFAOYSA-N
XLogP1.34
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-diphenyl-5H-indeno[1,2-b]pyridine
CID 71411540
N-(5H-indeno[1,2-b]pyridin-4-yl)acetamide
CID 12025246
4-(2-methoxyphenyl)-5-methyl-1H-pyrimidin-6-one
CID 136691870
2,4-dihydroindeno[1,2-c]pyrazole-3-carboxamide
CID 71282697
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene-9,10-dione
CID 606622
1-[2,3,4,5,6-pentakis(9H-fluoren-1-yl)phenyl]-9H-fluorene
CID 141308542
5-bromo-4-phenyl-1H-pyrimidin-6-one
CID 135502028
9H-fluorene-1,2,3,4-tetramine
CID 67197336
4-(2-fluorophenyl)-5-methoxy-1H-pyrimidin-6-one
CID 136692382
ethene;9H-fluorene
CID 159544077
2-[(5-oxo-4H-1,2,4-triazin-6-yl)methyl]-4H-isoquinoline-1,3-dione
CID 163466681

Frequently Asked Questions

What is the IUPAC name of 3,5-dihydroindeno[1,2-d]pyrimidin-4-one?
The IUPAC name of 3,5-dihydroindeno[1,2-d]pyrimidin-4-one (CID 135433734) is 3,5-dihydroindeno[1,2-d]pyrimidin-4-one.
What is the SMILES notation for 3,5-dihydroindeno[1,2-d]pyrimidin-4-one?
The canonical SMILES for 3,5-dihydroindeno[1,2-d]pyrimidin-4-one is O=c1[nH]cnc2c1Cc1ccccc1-2.
What is the InChIKey of 3,5-dihydroindeno[1,2-d]pyrimidin-4-one?
The InChIKey is MZXWRSBOVARRRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O/c14-11-9-5-7-3-1-2-4-8(7)10(9)12-6-13-11/h1-4,6H,5H2,(H,12,13,14).
What are the key properties of 3,5-dihydroindeno[1,2-d]pyrimidin-4-one?
3,5-dihydroindeno[1,2-d]pyrimidin-4-one has a molecular weight of 184.20 g/mol, XLogP of 1.34, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dihydroindeno[1,2-d]pyrimidin-4-one is sourced from PubChem (CID 135433734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).