4-propan-2-yloxy-1,3-diazinan-2-one

C7H14N2O2 — CID 23466235

IUPAC4-propan-2-yloxy-1,3-diazinan-2-one
SMILESCC(C)OC1CCNC(=O)N1
InChIInChI=1S/C7H14N2O2/c1-5(2)11-6-3-4-8-7(10)9-6/h5-6H,3-4H2,1-2H3,(H2,8,9,10)
InChIKeyHCZNOYAZBBHZRY-UHFFFAOYSA-N
MW158.20 g/mol
LogP0.44
Rot. Bonds2

About 4-propan-2-yloxy-1,3-diazinan-2-one

4-propan-2-yloxy-1,3-diazinan-2-one (PubChem CID 23466235) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 4-propan-2-yloxy-1,3-diazinan-2-one.

Molecular Properties

Compound Name4-propan-2-yloxy-1,3-diazinan-2-one
PubChem CID23466235
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name4-propan-2-yloxy-1,3-diazinan-2-one
SMILESCC(C)OC1CCNC(=O)N1
InChIInChI=1S/C7H14N2O2/c1-5(2)11-6-3-4-8-7(10)9-6/h5-6H,3-4H2,1-2H3,(H2,8,9,10)
InChIKeyHCZNOYAZBBHZRY-UHFFFAOYSA-N
XLogP0.44
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-Methoxytetrahydropyrimidin-2-one
CID 76677924
Tetrahydro-4-methoxy-5,5-dimethyl-1H-pyrimidin-2-one
CID 86578
6-Athoxy-3,4,5,6-tetrahydro-2(1H)-pyrimidinon
CID 78207115
Ureido-1,3-oxazinane
CID 129875743
4-Methoxy-5-methyl-1,3-diazinan-2-one
CID 55287477
2-Methyl-1,3,5-oxadiazinan-4-one
CID 58880532
2,6-Dimethyl-1,3,5-oxadiazinan-4-one
CID 58880534
2-Ethyl-1,3,5-oxadiazinan-4-one
CID 58880541
2-Ethyl-6-methyl-1,3,5-oxadiazinan-4-one
CID 58880542
4-[(2-Methylpropan-2-yl)oxy]-1,3-diazinan-2-one
CID 70568883
4-Ethoxy-6-methyltetrahydropyrimidin-2(1H)-one
CID 71420984
4-Butan-2-yloxy-4-[(2-methylpropan-2-yl)oxy]-1,3-diazinan-2-one
CID 153717151

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yloxy-1,3-diazinan-2-one?
The IUPAC name of 4-propan-2-yloxy-1,3-diazinan-2-one (CID 23466235) is 4-propan-2-yloxy-1,3-diazinan-2-one.
What is the SMILES notation for 4-propan-2-yloxy-1,3-diazinan-2-one?
The canonical SMILES for 4-propan-2-yloxy-1,3-diazinan-2-one is CC(C)OC1CCNC(=O)N1.
What is the InChIKey of 4-propan-2-yloxy-1,3-diazinan-2-one?
The InChIKey is HCZNOYAZBBHZRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-5(2)11-6-3-4-8-7(10)9-6/h5-6H,3-4H2,1-2H3,(H2,8,9,10).
What are the key properties of 4-propan-2-yloxy-1,3-diazinan-2-one?
4-propan-2-yloxy-1,3-diazinan-2-one has a molecular weight of 158.20 g/mol, XLogP of 0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yloxy-1,3-diazinan-2-one is sourced from PubChem (CID 23466235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).