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

C10H16N2O — CID 105438957

IUPAC4-cycloheptyl-1,3-dihydroimidazol-2-one
SMILESO=c1[nH]cc(C2CCCCCC2)[nH]1
InChIInChI=1S/C10H16N2O/c13-10-11-7-9(12-10)8-5-3-1-2-4-6-8/h7-8H,1-6H2,(H2,11,12,13)
InChIKeyYFZDCAFIKLGRNX-UHFFFAOYSA-N
MW180.25 g/mol
LogP2.14
Rot. Bonds1

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

4-cycloheptyl-1,3-dihydroimidazol-2-one (PubChem CID 105438957) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 4-cycloheptyl-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-cycloheptyl-1,3-dihydroimidazol-2-one
PubChem CID105438957
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name4-cycloheptyl-1,3-dihydroimidazol-2-one
SMILESO=c1[nH]cc(C2CCCCCC2)[nH]1
InChIInChI=1S/C10H16N2O/c13-10-11-7-9(12-10)8-5-3-1-2-4-6-8/h7-8H,1-6H2,(H2,11,12,13)
InChIKeyYFZDCAFIKLGRNX-UHFFFAOYSA-N
XLogP2.14
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

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2-cycloheptyl-1H-pyrrole;hydrochloride
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4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one
CID 105448418
4-cyclobutyl-6-cyclopropyl-1H-pyrimidin-2-one
CID 130056140
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CID 82415107

Frequently Asked Questions

What is the IUPAC name of 4-cycloheptyl-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-cycloheptyl-1,3-dihydroimidazol-2-one (CID 105438957) is 4-cycloheptyl-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-cycloheptyl-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-cycloheptyl-1,3-dihydroimidazol-2-one is O=c1[nH]cc(C2CCCCCC2)[nH]1.
What is the InChIKey of 4-cycloheptyl-1,3-dihydroimidazol-2-one?
The InChIKey is YFZDCAFIKLGRNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c13-10-11-7-9(12-10)8-5-3-1-2-4-6-8/h7-8H,1-6H2,(H2,11,12,13).
What are the key properties of 4-cycloheptyl-1,3-dihydroimidazol-2-one?
4-cycloheptyl-1,3-dihydroimidazol-2-one has a molecular weight of 180.25 g/mol, XLogP of 2.14, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cycloheptyl-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 105438957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).