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

C7H10N2O — CID 106951763

IUPAC2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one
SMILESCC1(C2=NCC(=O)N2)CC1
InChIInChI=1S/C7H10N2O/c1-7(2-3-7)6-8-4-5(10)9-6/h2-4H2,1H3,(H,8,9,10)
InChIKeyFBCMTBJAGUVTFF-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.31
Rot. Bonds1

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

2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one (PubChem CID 106951763) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one
PubChem CID106951763
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one
SMILESCC1(C2=NCC(=O)N2)CC1
InChIInChI=1S/C7H10N2O/c1-7(2-3-7)6-8-4-5(10)9-6/h2-4H2,1H3,(H,8,9,10)
InChIKeyFBCMTBJAGUVTFF-UHFFFAOYSA-N
XLogP0.31
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
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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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one?
The IUPAC name of 2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one (CID 106951763) is 2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one?
The canonical SMILES for 2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one is CC1(C2=NCC(=O)N2)CC1.
What is the InChIKey of 2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one?
The InChIKey is FBCMTBJAGUVTFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-7(2-3-7)6-8-4-5(10)9-6/h2-4H2,1H3,(H,8,9,10).
What are the key properties of 2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one?
2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one has a molecular weight of 138.17 g/mol, XLogP of 0.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylcyclopropyl)-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 106951763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).