2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one

C7H10N2O — CID 67131598

IUPAC2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one
SMILESO=C1CN=C(CC2CC2)N1
InChIInChI=1S/C7H10N2O/c10-7-4-8-6(9-7)3-5-1-2-5/h5H,1-4H2,(H,8,9,10)
InChIKeyBIAGCLSVNKCKAR-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.31
Rot. Bonds2

About 2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one

2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one (PubChem CID 67131598) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one
PubChem CID67131598
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one
SMILESO=C1CN=C(CC2CC2)N1
InChIInChI=1S/C7H10N2O/c10-7-4-8-6(9-7)3-5-1-2-5/h5H,1-4H2,(H,8,9,10)
InChIKeyBIAGCLSVNKCKAR-UHFFFAOYSA-N
XLogP0.31
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-butyl-3,5-dihydro-4H-imidazol-4-one
CID 10909654
2-(3-Methylbutyl)-1,4-dihydroimidazol-5-one
CID 20774502
2-Propan-2-yl-1,4-dihydroimidazol-5-one
CID 22898625
2-(2-Methylpropyl)-1,4-dihydroimidazol-5-one
CID 58718521
2-Pentyl-1,4-dihydroimidazol-5-one
CID 67877839
2-(4,4-Dimethylpentan-2-yl)-1,4-dihydroimidazol-5-one
CID 89273786
2-(1-Methylcyclopropyl)-1,4-dihydroimidazol-5-one
CID 106951763
2-Cyclobutyl-1,4-dihydroimidazol-5-one
CID 106951785
2-(2-Methylcyclopropyl)-1,4-dihydroimidazol-5-one
CID 106951883
2-Cyclopropyl-1,4-dihydroimidazol-5-one
CID 106951899
2-Butan-2-yl-1,4-dihydroimidazol-5-one
CID 106952000
2-Cyclopentyl-1,4-dihydroimidazol-5-one
CID 106952001

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one?
The IUPAC name of 2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one (CID 67131598) is 2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one?
The canonical SMILES for 2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one is O=C1CN=C(CC2CC2)N1.
What is the InChIKey of 2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one?
The InChIKey is BIAGCLSVNKCKAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c10-7-4-8-6(9-7)3-5-1-2-5/h5H,1-4H2,(H,8,9,10).
What are the key properties of 2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one?
2-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one has a molecular weight of 138.17 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-(cyclopropylmethyl)-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 67131598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).