1-(2-hydroxyphenyl)-1,3-diazinan-2-one

C10H12N2O2 — CID 11557437

IUPAC1-(2-hydroxyphenyl)-1,3-diazinan-2-one
SMILESO=C1NCCCN1c1ccccc1O
InChIInChI=1S/C10H12N2O2/c13-9-5-2-1-4-8(9)12-7-3-6-11-10(12)14/h1-2,4-5,13H,3,6-7H2,(H,11,14)
InChIKeyIORLQTNEVDQQHI-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.31
Rot. Bonds1

About 1-(2-hydroxyphenyl)-1,3-diazinan-2-one

1-(2-hydroxyphenyl)-1,3-diazinan-2-one (PubChem CID 11557437) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 1-(2-hydroxyphenyl)-1,3-diazinan-2-one.

Molecular Properties

Compound Name1-(2-hydroxyphenyl)-1,3-diazinan-2-one
PubChem CID11557437
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name1-(2-hydroxyphenyl)-1,3-diazinan-2-one
SMILESO=C1NCCCN1c1ccccc1O
InChIInChI=1S/C10H12N2O2/c13-9-5-2-1-4-8(9)12-7-3-6-11-10(12)14/h1-2,4-5,13H,3,6-7H2,(H,11,14)
InChIKeyIORLQTNEVDQQHI-UHFFFAOYSA-N
XLogP1.31
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyphenyl)-1,3-diazinan-2-one?
The IUPAC name of 1-(2-hydroxyphenyl)-1,3-diazinan-2-one (CID 11557437) is 1-(2-hydroxyphenyl)-1,3-diazinan-2-one.
What is the SMILES notation for 1-(2-hydroxyphenyl)-1,3-diazinan-2-one?
The canonical SMILES for 1-(2-hydroxyphenyl)-1,3-diazinan-2-one is O=C1NCCCN1c1ccccc1O.
What is the InChIKey of 1-(2-hydroxyphenyl)-1,3-diazinan-2-one?
The InChIKey is IORLQTNEVDQQHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c13-9-5-2-1-4-8(9)12-7-3-6-11-10(12)14/h1-2,4-5,13H,3,6-7H2,(H,11,14).
What are the key properties of 1-(2-hydroxyphenyl)-1,3-diazinan-2-one?
1-(2-hydroxyphenyl)-1,3-diazinan-2-one has a molecular weight of 192.22 g/mol, XLogP of 1.31, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyphenyl)-1,3-diazinan-2-one is sourced from PubChem (CID 11557437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).