2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine

C15H21N3O — CID 95466244

IUPAC2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine
SMILESCc1nc(-c2ccc(OC(C)C)cc2)cn1CCN
InChIInChI=1S/C15H21N3O/c1-11(2)19-14-6-4-13(5-7-14)15-10-18(9-8-16)12(3)17-15/h4-7,10-11H,8-9,16H2,1-3H3
InChIKeyFORQPAORNCQWDN-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.60
Rot. Bonds5

About 2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine

2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine (PubChem CID 95466244) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine.

Molecular Properties

Compound Name2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine
PubChem CID95466244
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine
SMILESCc1nc(-c2ccc(OC(C)C)cc2)cn1CCN
InChIInChI=1S/C15H21N3O/c1-11(2)19-14-6-4-13(5-7-14)15-10-18(9-8-16)12(3)17-15/h4-7,10-11H,8-9,16H2,1-3H3
InChIKeyFORQPAORNCQWDN-UHFFFAOYSA-N
XLogP2.60
TPSA53.07 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 ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-methyl-4-(3-methyl-4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine
CID 95475893
2-[2-methyl-4-[4-[(2-methylpropan-2-yl)oxy]phenyl]imidazol-1-yl]ethanamine
CID 95475760
2-[2-methyl-4-(4-propylphenyl)imidazol-1-yl]ethanamine
CID 95456247
2-[4-(3,4-dimethylphenyl)-2-methylimidazol-1-yl]ethanamine
CID 82288563
4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine
CID 157488014
3-[4-(4-propan-2-yloxyphenyl)pyrazol-1-yl]propan-1-amine
CID 164608378
2,3-dimethyl-5-(4-propan-2-yloxyphenyl)imidazol-4-amine
CID 55047871
[2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]methanol
CID 82356958
6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 115404928
6-bromo-5-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 115403727
N'-[4-methyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-yl]propane-1,3-diamine
CID 82191630
2-[4-(4-propan-2-yloxyphenyl)phenyl]ethanamine
CID 39357518

Frequently Asked Questions

What is the IUPAC name of 2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine?
The IUPAC name of 2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine (CID 95466244) is 2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine.
What is the SMILES notation for 2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine?
The canonical SMILES for 2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine is Cc1nc(-c2ccc(OC(C)C)cc2)cn1CCN.
What is the InChIKey of 2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine?
The InChIKey is FORQPAORNCQWDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-11(2)19-14-6-4-13(5-7-14)15-10-18(9-8-16)12(3)17-15/h4-7,10-11H,8-9,16H2,1-3H3.
What are the key properties of 2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine?
2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine has a molecular weight of 259.35 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine is sourced from PubChem (CID 95466244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).