2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine

C14H19N3O — CID 95457147

IUPAC2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine
SMILESCC(C)Oc1ccc(-c2nc[nH]c2CCN)cc1
InChIInChI=1S/C14H19N3O/c1-10(2)18-12-5-3-11(4-6-12)14-13(7-8-15)16-9-17-14/h3-6,9-10H,7-8,15H2,1-2H3,(H,16,17)
InChIKeyFWLJPQJEVHGCHQ-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.37
Rot. Bonds5

About 2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine

2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine (PubChem CID 95457147) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine.

Molecular Properties

Compound Name2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine
PubChem CID95457147
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine
SMILESCC(C)Oc1ccc(-c2nc[nH]c2CCN)cc1
InChIInChI=1S/C14H19N3O/c1-10(2)18-12-5-3-11(4-6-12)14-13(7-8-15)16-9-17-14/h3-6,9-10H,7-8,15H2,1-2H3,(H,16,17)
InChIKeyFWLJPQJEVHGCHQ-UHFFFAOYSA-N
XLogP2.37
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine
CID 117000099
2-[4-[4-(2-methylpropyl)phenyl]-1H-imidazol-5-yl]ethanamine
CID 95456243
2-[4-(4-propan-2-yloxyphenyl)-1,3-thiazol-5-yl]ethanamine
CID 82104465
2-[4-(4-propan-2-yloxyphenyl)phenyl]ethanamine
CID 39357518
[4-(3-chloro-4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]methanamine
CID 82304284
[3-(4-propan-2-yloxyphenyl)pyrazin-2-yl]methanamine
CID 82478088
2-[4-(2,4-dimethoxyphenyl)-1H-imidazol-5-yl]ethanamine
CID 39101589
[2-(4-propan-2-yloxyphenyl)-3-pyridinyl]methanamine
CID 117001852
2-(4-thiophen-2-yl-1H-imidazol-5-yl)ethanamine
CID 39101600
2-[5-(4-propan-2-yloxyphenyl)thiophen-2-yl]ethanamine
CID 94274161
2-[4-(2-methoxyphenyl)-1H-imidazol-5-yl]ethanamine
CID 82285156
2-[5-(4-propan-2-yloxyphenyl)-1H-indol-3-yl]ethanamine;hydrochloride
CID 75366101

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine?
The IUPAC name of 2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine (CID 95457147) is 2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine.
What is the SMILES notation for 2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine?
The canonical SMILES for 2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine is CC(C)Oc1ccc(-c2nc[nH]c2CCN)cc1.
What is the InChIKey of 2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine?
The InChIKey is FWLJPQJEVHGCHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-10(2)18-12-5-3-11(4-6-12)14-13(7-8-15)16-9-17-14/h3-6,9-10H,7-8,15H2,1-2H3,(H,16,17).
What are the key properties of 2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine?
2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine has a molecular weight of 245.33 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-propan-2-yloxyphenyl)-1H-imidazol-5-yl]ethanamine is sourced from PubChem (CID 95457147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).