4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one

C11H18N2O — CID 105448418

IUPAC4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one
SMILESCc1[nH]c(=O)[nH]c1C1CCCCCC1
InChIInChI=1S/C11H18N2O/c1-8-10(13-11(14)12-8)9-6-4-2-3-5-7-9/h9H,2-7H2,1H3,(H2,12,13,14)
InChIKeyCTGIOQUSVCXLBZ-UHFFFAOYSA-N
MW194.28 g/mol
LogP2.45
Rot. Bonds1

About 4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one

4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one (PubChem CID 105448418) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one
PubChem CID105448418
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one
SMILESCc1[nH]c(=O)[nH]c1C1CCCCCC1
InChIInChI=1S/C11H18N2O/c1-8-10(13-11(14)12-8)9-6-4-2-3-5-7-9/h9H,2-7H2,1H3,(H2,12,13,14)
InChIKeyCTGIOQUSVCXLBZ-UHFFFAOYSA-N
XLogP2.45
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 173177234
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2-cycloheptyl-3-methyl-1H-pyrrole
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5-cycloundecyl-4-methyl-1H-pyrazole
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5-bromo-6-cyclohexyl-1,3-dihydroimidazo[4,5-b]pyrazin-2-one
CID 118431154
3-cyclohexyl-6-methyl-1H-pyrazin-2-one
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2-cyclohexyl-5-methyl-1H-imidazole-4-carbaldehyde
CID 83637053
2-cyclohexyl-5-methylpyrrol-3-one
CID 141202518
4-(2-amino-1-hydroxyethyl)-5-cyclobutyl-1,3-dihydroimidazol-2-one
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CID 101018406

Frequently Asked Questions

What is the IUPAC name of 4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one (CID 105448418) is 4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one is Cc1[nH]c(=O)[nH]c1C1CCCCCC1.
What is the InChIKey of 4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one?
The InChIKey is CTGIOQUSVCXLBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-8-10(13-11(14)12-8)9-6-4-2-3-5-7-9/h9H,2-7H2,1H3,(H2,12,13,14).
What are the key properties of 4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one?
4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one has a molecular weight of 194.28 g/mol, XLogP of 2.45, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cycloheptyl-5-methyl-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 105448418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).