N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine

C16H23N3O — CID 106563494

IUPACN-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine
SMILESCOc1cccc(CNc2nc(C)cn2CC(C)C)c1
InChIInChI=1S/C16H23N3O/c1-12(2)10-19-11-13(3)18-16(19)17-9-14-6-5-7-15(8-14)20-4/h5-8,11-12H,9-10H2,1-4H3,(H,17,18)
InChIKeyRUOWHPZBXWXVJY-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.47
Rot. Bonds6

About N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine

N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine (PubChem CID 106563494) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine
PubChem CID106563494
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC NameN-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine
SMILESCOc1cccc(CNc2nc(C)cn2CC(C)C)c1
InChIInChI=1S/C16H23N3O/c1-12(2)10-19-11-13(3)18-16(19)17-9-14-6-5-7-15(8-14)20-4/h5-8,11-12H,9-10H2,1-4H3,(H,17,18)
InChIKeyRUOWHPZBXWXVJY-UHFFFAOYSA-N
XLogP3.47
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopentyl-N-[(3-methoxyphenyl)methyl]-4-methylimidazol-2-amine
CID 106563505
4-methyl-1-(2-methylpropyl)-N-(3-phenylpropyl)imidazol-2-amine
CID 106563183
4-methoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine
CID 112690994
4-methyl-1-(2-methylpropyl)-N-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine
CID 106577993
4-methyl-1-(2-methylpropyl)-N-[(1-methylpyrazol-3-yl)methyl]imidazol-2-amine
CID 106579067
3-methoxy-N-[[3-(2-methylpropoxy)phenyl]methyl]aniline
CID 39386919
2-N-[(3-methoxyphenyl)methyl]-6-methylpyridine-2,3-diamine
CID 81131728
N-[(3-methoxyphenyl)methyl]-2,5-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 122174850
N-[(3-methoxyphenyl)methyl]-1-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106563491
N',N'-dimethyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]propane-1,3-diamine
CID 106559563
N-(2-ethoxyethyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106554059
N-(3-iodophenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106554218

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine (CID 106563494) is N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine is COc1cccc(CNc2nc(C)cn2CC(C)C)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
The InChIKey is RUOWHPZBXWXVJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-12(2)10-19-11-13(3)18-16(19)17-9-14-6-5-7-15(8-14)20-4/h5-8,11-12H,9-10H2,1-4H3,(H,17,18).
What are the key properties of N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine has a molecular weight of 273.38 g/mol, XLogP of 3.47, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-4-methyl-1-(2-methylpropyl)imidazol-2-amine is sourced from PubChem (CID 106563494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).