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

C6H12N2O2 — CID 55288148

IUPAC1-(2-hydroxyethyl)-1,3-diazinan-2-one
SMILESO=C1NCCCN1CCO
InChIInChI=1S/C6H12N2O2/c9-5-4-8-3-1-2-7-6(8)10/h9H,1-5H2,(H,7,10)
InChIKeySNUUBCVNJIAAML-UHFFFAOYSA-N
MW144.17 g/mol
LogP-0.61
Rot. Bonds2

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

1-(2-hydroxyethyl)-1,3-diazinan-2-one (PubChem CID 55288148) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-1,3-diazinan-2-one.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-1,3-diazinan-2-one
PubChem CID55288148
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name1-(2-hydroxyethyl)-1,3-diazinan-2-one
SMILESO=C1NCCCN1CCO
InChIInChI=1S/C6H12N2O2/c9-5-4-8-3-1-2-7-6(8)10/h9H,1-5H2,(H,7,10)
InChIKeySNUUBCVNJIAAML-UHFFFAOYSA-N
XLogP-0.61
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)-1,3-diazinan-2-one?
The IUPAC name of 1-(2-hydroxyethyl)-1,3-diazinan-2-one (CID 55288148) is 1-(2-hydroxyethyl)-1,3-diazinan-2-one.
What is the SMILES notation for 1-(2-hydroxyethyl)-1,3-diazinan-2-one?
The canonical SMILES for 1-(2-hydroxyethyl)-1,3-diazinan-2-one is O=C1NCCCN1CCO.
What is the InChIKey of 1-(2-hydroxyethyl)-1,3-diazinan-2-one?
The InChIKey is SNUUBCVNJIAAML-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c9-5-4-8-3-1-2-7-6(8)10/h9H,1-5H2,(H,7,10).
What are the key properties of 1-(2-hydroxyethyl)-1,3-diazinan-2-one?
1-(2-hydroxyethyl)-1,3-diazinan-2-one has a molecular weight of 144.17 g/mol, XLogP of -0.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-1,3-diazinan-2-one is sourced from PubChem (CID 55288148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).