N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine

C15H21N3O — CID 106581312

IUPACN-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine
SMILESCOC(C)(C)CNc1nc(C)cn1-c1ccccc1
InChIInChI=1S/C15H21N3O/c1-12-10-18(13-8-6-5-7-9-13)14(17-12)16-11-15(2,3)19-4/h5-10H,11H2,1-4H3,(H,16,17)
InChIKeyBZKLMFCSXGWLAV-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.02
Rot. Bonds5

About N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine

N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine (PubChem CID 106581312) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine.

Molecular Properties

Compound NameN-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine
PubChem CID106581312
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC NameN-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine
SMILESCOC(C)(C)CNc1nc(C)cn1-c1ccccc1
InChIInChI=1S/C15H21N3O/c1-12-10-18(13-8-6-5-7-9-13)14(17-12)16-11-15(2,3)19-4/h5-10H,11H2,1-4H3,(H,16,17)
InChIKeyBZKLMFCSXGWLAV-UHFFFAOYSA-N
XLogP3.02
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine
CID 106554707
4-methyl-N-[2-(2-methylpropoxy)ethyl]-1-phenylimidazol-2-amine
CID 106582396
N',N'-dimethyl-N-(4-methyl-1-phenylimidazol-2-yl)ethane-1,2-diamine
CID 106555123
4-methyl-N-(2-methylsulfinylethyl)-1-phenylimidazol-2-amine
CID 106581417
4-methyl-N-(3-methylsulfinylpropyl)-1-phenylimidazol-2-amine
CID 106580561
N-[(5-chlorothiophen-2-yl)methyl]-4-methyl-1-phenylimidazol-2-amine
CID 106575438
N-[(3-chlorophenyl)methyl]-4-methyl-1-phenylimidazol-2-amine
CID 106570145
4-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-phenylimidazol-2-amine
CID 106573444
4-methyl-1-phenyl-N-(2-thiophen-3-ylethyl)imidazol-2-amine
CID 106567558
4-methyl-1-phenyl-N-(3-pyrazol-1-ylpropyl)imidazol-2-amine
CID 106579674
N-(1-methoxypentan-2-yl)-4-methyl-1-phenylimidazol-2-amine
CID 106574831
4-methyl-N-(1-methylcyclohexyl)-1-phenylimidazol-2-amine
CID 106565725

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine?
The IUPAC name of N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine (CID 106581312) is N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine.
What is the SMILES notation for N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine?
The canonical SMILES for N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine is COC(C)(C)CNc1nc(C)cn1-c1ccccc1.
What is the InChIKey of N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine?
The InChIKey is BZKLMFCSXGWLAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-12-10-18(13-8-6-5-7-9-13)14(17-12)16-11-15(2,3)19-4/h5-10H,11H2,1-4H3,(H,16,17).
What are the key properties of N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine?
N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine has a molecular weight of 259.35 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-2-methylpropyl)-4-methyl-1-phenylimidazol-2-amine is sourced from PubChem (CID 106581312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).