3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine

C18H27N3 — CID 63468172

IUPAC3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine
SMILESCCCCn1c(CC)nc(-c2c(C)cc(C)cc2C)c1N
InChIInChI=1S/C18H27N3/c1-6-8-9-21-15(7-2)20-17(18(21)19)16-13(4)10-12(3)11-14(16)5/h10-11H,6-9,19H2,1-5H3
InChIKeyDHIFIWNJHSGJND-UHFFFAOYSA-N
MW285.44 g/mol
LogP4.42
Rot. Bonds5

About 3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine

3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine (PubChem CID 63468172) has the molecular formula C18H27N3 and a molecular weight of 285.44 g/mol. Its IUPAC name is 3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine.

Molecular Properties

Compound Name3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine
PubChem CID63468172
Molecular FormulaC18H27N3
Molecular Weight285.44 g/mol
Exact Mass285.22
IUPAC Name3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine
SMILESCCCCn1c(CC)nc(-c2c(C)cc(C)cc2C)c1N
InChIInChI=1S/C18H27N3/c1-6-8-9-21-15(7-2)20-17(18(21)19)16-13(4)10-12(3)11-14(16)5/h10-11H,6-9,19H2,1-5H3
InChIKeyDHIFIWNJHSGJND-UHFFFAOYSA-N
XLogP4.42
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.44
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-butyl-5-(2,6-difluorophenyl)-2-ethylimidazol-4-amine
CID 62218493
3-butyl-2-ethyl-5-(4-fluorophenyl)imidazol-4-amine
CID 55048354
3-butyl-5-(3,4-difluorophenyl)-2-ethylimidazol-4-amine
CID 62219554
3-butyl-2-ethyl-5-(4-propan-2-ylphenyl)imidazol-4-amine
CID 63467991
3-butyl-2-ethyl-5-(2-fluorophenyl)imidazol-4-amine
CID 62219729
3-propan-2-yl-2-propyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine
CID 62220297
1-butyl-4,5-dimethyl-2-(2,4,6-trimethylphenyl)imidazole
CID 142562424
3-butyl-5-(2,3-dichlorophenyl)-2-ethylimidazol-4-amine
CID 63468358
5-(3-bromo-4-methoxyphenyl)-3-butyl-2-ethylimidazol-4-amine
CID 62219915
5-(3-chloro-5-fluorophenyl)-2-ethyl-3-propylimidazol-4-amine
CID 114454434
3-butyl-5-(4-ethylphenyl)-2-propylimidazol-4-amine
CID 63468177
3-butyl-2-ethyl-5-heptylimidazol-4-amine
CID 63469087

Frequently Asked Questions

What is the IUPAC name of 3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine?
The IUPAC name of 3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine (CID 63468172) is 3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine.
What is the SMILES notation for 3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine?
The canonical SMILES for 3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine is CCCCn1c(CC)nc(-c2c(C)cc(C)cc2C)c1N.
What is the InChIKey of 3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine?
The InChIKey is DHIFIWNJHSGJND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3/c1-6-8-9-21-15(7-2)20-17(18(21)19)16-13(4)10-12(3)11-14(16)5/h10-11H,6-9,19H2,1-5H3.
What are the key properties of 3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine?
3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine has a molecular weight of 285.44 g/mol, XLogP of 4.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butyl-2-ethyl-5-(2,4,6-trimethylphenyl)imidazol-4-amine is sourced from PubChem (CID 63468172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).