1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine

C11H21N3O — CID 23266491

IUPAC1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine
SMILESCC(C)/N=C/C1=NC(C)(C)N(O)C1(C)C
InChIInChI=1S/C11H21N3O/c1-8(2)12-7-9-10(3,4)14(15)11(5,6)13-9/h7-8,15H,1-6H3/b12-7+
InChIKeyPATLPNPPNORYFI-KPKJPENVSA-N
MW211.31 g/mol
LogP2.13
Rot. Bonds2

About 1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine

1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine (PubChem CID 23266491) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine.

Molecular Properties

Compound Name1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine
PubChem CID23266491
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine
SMILESCC(C)/N=C/C1=NC(C)(C)N(O)C1(C)C
InChIInChI=1S/C11H21N3O/c1-8(2)12-7-9-10(3,4)14(15)11(5,6)13-9/h7-8,15H,1-6H3/b12-7+
InChIKeyPATLPNPPNORYFI-KPKJPENVSA-N
XLogP2.13
TPSA48.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2,2,4,5,5-Pentamethyl-1-imidazolidinol 3-oxide
CID 379371
2,2,4,5,5-Pentamethyl-2,5-dihydro-1H-imidazol-1-ol
CID 379370
1-Hydroxy-4-hydroxyiminomethyl-2,2,5,5-tetramethyl-3-imidazoline
CID 135509155
4-t-Butyliminomethyl-2,2,5,5-tetramethyl-3-imidazoline 3-oxide
CID 12513353
2,4,5,5-Tetramethyl-2-oximinoethyl-3-imidazoline 3-oxide
CID 129809285
1-Hydroxy-4-hydrazonomethyl-2,2,5,5-tetramethyl-3-imidazoline
CID 9601434
N-[(E)-(1-hydroxy-2,2,5,5-tetramethyl-3-oxidoimidazol-3-ium-4-yl)methylideneamino]-N-methylmethanamine
CID 9601642
1-Hydroxy-4-methoxyiminomethyl-2,2,5,5-tetramethyl-3-imidazoline
CID 9603395
1-Hydroxy-4-dimethylhydrazonomethyl-2,2,5,5-tetramethyl-3-imidazoline
CID 9603508
4-Hydroxyiminomethyl-2,2,5,5-tetramethyl-3-imidazoline-1-oyl
CID 135592978
CID 177582465
CID 177582465
CID 177584529
CID 177584529

Frequently Asked Questions

What is the IUPAC name of 1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine?
The IUPAC name of 1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine (CID 23266491) is 1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine.
What is the SMILES notation for 1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine?
The canonical SMILES for 1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine is CC(C)/N=C/C1=NC(C)(C)N(O)C1(C)C.
What is the InChIKey of 1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine?
The InChIKey is PATLPNPPNORYFI-KPKJPENVSA-N. The full InChI is InChI=1S/C11H21N3O/c1-8(2)12-7-9-10(3,4)14(15)11(5,6)13-9/h7-8,15H,1-6H3/b12-7+.
What are the key properties of 1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine?
1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine has a molecular weight of 211.31 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-hydroxy-2,2,5,5-tetramethylimidazol-4-yl)-N-propan-2-ylmethanimine is sourced from PubChem (CID 23266491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).