3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine

C8H17N2O2- — CID 21142885

IUPAC3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine
SMILESCC1N([O-])C(C)(C)N(O)C1(C)C
InChIInChI=1S/C8H17N2O2/c1-6-7(2,3)10(12)8(4,5)9(6)11/h6,12H,1-5H3/q-1
InChIKeyFZEGPCMRHBWRJW-UHFFFAOYSA-N
MW173.24 g/mol
LogP1.39
Rot. Bonds

About 3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine

3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine (PubChem CID 21142885) has the molecular formula C8H17N2O2- and a molecular weight of 173.24 g/mol. Its IUPAC name is 3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine.

Molecular Properties

Compound Name3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine
PubChem CID21142885
Molecular FormulaC8H17N2O2-
Molecular Weight173.24 g/mol
Exact Mass173.13
IUPAC Name3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine
SMILESCC1N([O-])C(C)(C)N(O)C1(C)C
InChIInChI=1S/C8H17N2O2/c1-6-7(2,3)10(12)8(4,5)9(6)11/h6,12H,1-5H3/q-1
InChIKeyFZEGPCMRHBWRJW-UHFFFAOYSA-N
XLogP1.39
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.24
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine?
The IUPAC name of 3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine (CID 21142885) is 3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine.
What is the SMILES notation for 3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine?
The canonical SMILES for 3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine is CC1N([O-])C(C)(C)N(O)C1(C)C.
What is the InChIKey of 3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine?
The InChIKey is FZEGPCMRHBWRJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N2O2/c1-6-7(2,3)10(12)8(4,5)9(6)11/h6,12H,1-5H3/q-1.
What are the key properties of 3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine?
3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine has a molecular weight of 173.24 g/mol, XLogP of 1.39, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2,2,4,4,5-pentamethyl-1-oxidoimidazolidine is sourced from PubChem (CID 21142885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).