4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine

C5H10N2O — CID 13460453

IUPAC4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine
SMILESCC1N=C(N)OC1C
InChIInChI=1S/C5H10N2O/c1-3-4(2)8-5(6)7-3/h3-4H,1-2H3,(H2,6,7)
InChIKeyCBBZZWUQMBKNEY-UHFFFAOYSA-N
MW114.15 g/mol
LogP0.11
Rot. Bonds

About 4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine

4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine (PubChem CID 13460453) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is 4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine.

Molecular Properties

Compound Name4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine
PubChem CID13460453
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine
SMILESCC1N=C(N)OC1C
InChIInChI=1S/C5H10N2O/c1-3-4(2)8-5(6)7-3/h3-4H,1-2H3,(H2,6,7)
InChIKeyCBBZZWUQMBKNEY-UHFFFAOYSA-N
XLogP0.11
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine?
The IUPAC name of 4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine (CID 13460453) is 4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine.
What is the SMILES notation for 4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine?
The canonical SMILES for 4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine is CC1N=C(N)OC1C.
What is the InChIKey of 4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine?
The InChIKey is CBBZZWUQMBKNEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O/c1-3-4(2)8-5(6)7-3/h3-4H,1-2H3,(H2,6,7).
What are the key properties of 4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine?
4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine has a molecular weight of 114.15 g/mol, XLogP of 0.11, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-4,5-dihydro-1,3-oxazol-2-amine is sourced from PubChem (CID 13460453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).