2-propyl-1,4-dihydroimidazol-5-one

C6H10N2O — CID 19391756

IUPAC2-propyl-1,4-dihydroimidazol-5-one
SMILESCCCC1=NCC(=O)N1
InChIInChI=1S/C6H10N2O/c1-2-3-5-7-4-6(9)8-5/h2-4H2,1H3,(H,7,8,9)
InChIKeyBDSFPJPUFHGKLX-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.31
Rot. Bonds2

About 2-propyl-1,4-dihydroimidazol-5-one

2-propyl-1,4-dihydroimidazol-5-one (PubChem CID 19391756) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 2-propyl-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name2-propyl-1,4-dihydroimidazol-5-one
PubChem CID19391756
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name2-propyl-1,4-dihydroimidazol-5-one
SMILESCCCC1=NCC(=O)N1
InChIInChI=1S/C6H10N2O/c1-2-3-5-7-4-6(9)8-5/h2-4H2,1H3,(H,7,8,9)
InChIKeyBDSFPJPUFHGKLX-UHFFFAOYSA-N
XLogP0.31
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methyl-1,4-dihydroimidazol-5-one
CID 348554
2-Ethyl-3,5-dihydroimidazol-4-one
CID 57435862
2-(3,4-dihydro-2H-pyrrol-5-ylamino)acetamide
CID 79508754
2-(2,2,2-Trifluoroethyl)-1,4-dihydroimidazol-5-one
CID 106951807
2-(3,3,3-Trifluoropropyl)-1,4-dihydroimidazol-5-one
CID 106951988
4-Methyl-2-(3,3,3-trifluoropropyl)-1,4-dihydroimidazol-5-one
CID 106952252
4-Ethyl-2-(2,2,2-trifluoroethyl)-1,4-dihydroimidazol-5-one
CID 106952587
2-(2-Aminoethyl)-4-methyl-1,4-dihydroimidazol-5-one
CID 10290843
2-butyl-3,5-dihydro-4H-imidazol-4-one
CID 10909654
2,4-Dimethyl-1,4-dihydroimidazol-5-one
CID 11571792
4-Methyl-2-propan-2-yl-1,4-dihydroimidazol-5-one
CID 18961683
4,4-dimethyl-2-propyl-1H-imidazol-5-one
CID 19933477

Frequently Asked Questions

What is the IUPAC name of 2-propyl-1,4-dihydroimidazol-5-one?
The IUPAC name of 2-propyl-1,4-dihydroimidazol-5-one (CID 19391756) is 2-propyl-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 2-propyl-1,4-dihydroimidazol-5-one?
The canonical SMILES for 2-propyl-1,4-dihydroimidazol-5-one is CCCC1=NCC(=O)N1.
What is the InChIKey of 2-propyl-1,4-dihydroimidazol-5-one?
The InChIKey is BDSFPJPUFHGKLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-2-3-5-7-4-6(9)8-5/h2-4H2,1H3,(H,7,8,9).
What are the key properties of 2-propyl-1,4-dihydroimidazol-5-one?
2-propyl-1,4-dihydroimidazol-5-one has a molecular weight of 126.16 g/mol, XLogP of 0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 19391756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).