5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one

C10H17N3O — CID 79959248

IUPAC5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one
SMILESCN1C(=O)N=C(N)C1C1CCCCC1
InChIInChI=1S/C10H17N3O/c1-13-8(9(11)12-10(13)14)7-5-3-2-4-6-7/h7-8H,2-6H2,1H3,(H2,11,12,14)
InChIKeyOVQRIZGEOJKZNP-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.36
Rot. Bonds1

About 5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one

5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one (PubChem CID 79959248) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one.

Molecular Properties

Compound Name5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one
PubChem CID79959248
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one
SMILESCN1C(=O)N=C(N)C1C1CCCCC1
InChIInChI=1S/C10H17N3O/c1-13-8(9(11)12-10(13)14)7-5-3-2-4-6-7/h7-8H,2-6H2,1H3,(H2,11,12,14)
InChIKeyOVQRIZGEOJKZNP-UHFFFAOYSA-N
XLogP1.36
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one?
The IUPAC name of 5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one (CID 79959248) is 5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one.
What is the SMILES notation for 5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one?
The canonical SMILES for 5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one is CN1C(=O)N=C(N)C1C1CCCCC1.
What is the InChIKey of 5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one?
The InChIKey is OVQRIZGEOJKZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13-8(9(11)12-10(13)14)7-5-3-2-4-6-7/h7-8H,2-6H2,1H3,(H2,11,12,14).
What are the key properties of 5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one?
5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one has a molecular weight of 195.27 g/mol, XLogP of 1.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-cyclohexyl-3-methyl-4H-imidazol-2-one is sourced from PubChem (CID 79959248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).