N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine

C17H25N3O — CID 106555375

IUPACN-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
SMILESCCc1cccc(C)c1Nc1nc(C)cn1C(C)COC
InChIInChI=1S/C17H25N3O/c1-6-15-9-7-8-12(2)16(15)19-17-18-13(3)10-20(17)14(4)11-21-5/h7-10,14H,6,11H2,1-5H3,(H,18,19)
InChIKeyVGBQGIQIRGYVRQ-UHFFFAOYSA-N
MW287.41 g/mol
LogP4.01
Rot. Bonds6

About N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine

N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine (PubChem CID 106555375) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
PubChem CID106555375
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC NameN-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
SMILESCCc1cccc(C)c1Nc1nc(C)cn1C(C)COC
InChIInChI=1S/C17H25N3O/c1-6-15-9-7-8-12(2)16(15)19-17-18-13(3)10-20(17)14(4)11-21-5/h7-10,14H,6,11H2,1-5H3,(H,18,19)
InChIKeyVGBQGIQIRGYVRQ-UHFFFAOYSA-N
XLogP4.01
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chloro-6-fluorophenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106582325
1-(1-methoxypropan-2-yl)-4-methyl-N-[1-(2-methylphenyl)ethyl]imidazol-2-amine
CID 106567416
N-(2,6-diethylphenyl)-1-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106556075
1-(1-methoxypropan-2-yl)-4-methyl-N-(4-propan-2-ylphenyl)imidazol-2-amine
CID 106557337
N-(4-bromo-2,6-difluorophenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106574062
1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine
CID 106554728
1-cyclopentyl-N-(2-ethyl-6-methylphenyl)-4-methylimidazol-2-amine
CID 106555380
1-(1-methoxypropan-2-yl)-4-methyl-N-(2-methylpyrazol-3-yl)imidazol-2-amine
CID 106565839
N-(3,5-difluorophenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106559723
1-(1-methoxypropan-2-yl)-4-methyl-N-(3-methylbutan-2-yl)imidazol-2-amine
CID 106554321
2-ethyl-N-(3-methoxy-2-methylpropyl)-6-methylaniline
CID 116501156
N-(1-methoxy-3-methylbutan-2-yl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106575059

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine (CID 106555375) is N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine is CCc1cccc(C)c1Nc1nc(C)cn1C(C)COC.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
The InChIKey is VGBQGIQIRGYVRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-6-15-9-7-8-12(2)16(15)19-17-18-13(3)10-20(17)14(4)11-21-5/h7-10,14H,6,11H2,1-5H3,(H,18,19).
What are the key properties of N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine?
N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine has a molecular weight of 287.41 g/mol, XLogP of 4.01, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine is sourced from PubChem (CID 106555375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).