4-propyl-1,3-dihydroimidazol-2-one

C6H10N2O — CID 15567529

IUPAC4-propyl-1,3-dihydroimidazol-2-one
SMILESCCCc1c[nH]c(=O)[nH]1
InChIInChI=1S/C6H10N2O/c1-2-3-5-4-7-6(9)8-5/h4H,2-3H2,1H3,(H2,7,8,9)
InChIKeyXVRUDUVVABJXSC-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.66
Rot. Bonds2

About 4-propyl-1,3-dihydroimidazol-2-one

4-propyl-1,3-dihydroimidazol-2-one (PubChem CID 15567529) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 4-propyl-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-propyl-1,3-dihydroimidazol-2-one
PubChem CID15567529
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name4-propyl-1,3-dihydroimidazol-2-one
SMILESCCCc1c[nH]c(=O)[nH]1
InChIInChI=1S/C6H10N2O/c1-2-3-5-4-7-6(9)8-5/h4H,2-3H2,1H3,(H2,7,8,9)
InChIKeyXVRUDUVVABJXSC-UHFFFAOYSA-N
XLogP0.66
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-propyl-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-propyl-1,3-dihydroimidazol-2-one (CID 15567529) is 4-propyl-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-propyl-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-propyl-1,3-dihydroimidazol-2-one is CCCc1c[nH]c(=O)[nH]1.
What is the InChIKey of 4-propyl-1,3-dihydroimidazol-2-one?
The InChIKey is XVRUDUVVABJXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-2-3-5-4-7-6(9)8-5/h4H,2-3H2,1H3,(H2,7,8,9).
What are the key properties of 4-propyl-1,3-dihydroimidazol-2-one?
4-propyl-1,3-dihydroimidazol-2-one has a molecular weight of 126.16 g/mol, XLogP of 0.66, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propyl-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 15567529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).