5-tert-butyl-3-methyl-2-propylimidazol-4-amine

C11H21N3 — CID 62218689

IUPAC5-tert-butyl-3-methyl-2-propylimidazol-4-amine
SMILESCCCc1nc(C(C)(C)C)c(N)n1C
InChIInChI=1S/C11H21N3/c1-6-7-8-13-9(11(2,3)4)10(12)14(8)5/h6-7,12H2,1-5H3
InChIKeySWKFUUYBHGMSEJ-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.25
Rot. Bonds2

About 5-tert-butyl-3-methyl-2-propylimidazol-4-amine

5-tert-butyl-3-methyl-2-propylimidazol-4-amine (PubChem CID 62218689) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 5-tert-butyl-3-methyl-2-propylimidazol-4-amine.

Molecular Properties

Compound Name5-tert-butyl-3-methyl-2-propylimidazol-4-amine
PubChem CID62218689
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name5-tert-butyl-3-methyl-2-propylimidazol-4-amine
SMILESCCCc1nc(C(C)(C)C)c(N)n1C
InChIInChI=1S/C11H21N3/c1-6-7-8-13-9(11(2,3)4)10(12)14(8)5/h6-7,12H2,1-5H3
InChIKeySWKFUUYBHGMSEJ-UHFFFAOYSA-N
XLogP2.25
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-tert-butyl-2-propylimidazole-1,5-diamine
CID 62506102
5-tert-butyl-3-(2-methylpropyl)-2-propylimidazol-4-amine
CID 62221052
2-(5-ethyl-1-methyl-2-propylimidazol-4-yl)propan-2-ol
CID 118328936
5-(4-fluorophenyl)-3-methyl-2-propylimidazol-4-amine
CID 62220284
3-methyl-5-(1-methylpyrazol-4-yl)-2-propylimidazol-4-amine
CID 62219046
5-(2,4-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine
CID 62219048
5-(2,3-dimethylphenyl)-3-methyl-2-propylimidazol-4-amine
CID 62220287
5-(2,3-dichlorophenyl)-3-methyl-2-propylimidazol-4-amine
CID 62219220
3-methyl-5-(oxan-3-yl)-2-propylimidazol-4-amine
CID 63737711
5-butyl-3-tert-butyl-2-propylimidazol-4-amine
CID 62219587
5-(3,4-dimethoxyphenyl)-3-methyl-2-propylimidazol-4-amine
CID 62220657
5-(3-chloro-2-fluorophenyl)-3-methyl-2-propylimidazol-4-amine
CID 114488583

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-3-methyl-2-propylimidazol-4-amine?
The IUPAC name of 5-tert-butyl-3-methyl-2-propylimidazol-4-amine (CID 62218689) is 5-tert-butyl-3-methyl-2-propylimidazol-4-amine.
What is the SMILES notation for 5-tert-butyl-3-methyl-2-propylimidazol-4-amine?
The canonical SMILES for 5-tert-butyl-3-methyl-2-propylimidazol-4-amine is CCCc1nc(C(C)(C)C)c(N)n1C.
What is the InChIKey of 5-tert-butyl-3-methyl-2-propylimidazol-4-amine?
The InChIKey is SWKFUUYBHGMSEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-6-7-8-13-9(11(2,3)4)10(12)14(8)5/h6-7,12H2,1-5H3.
What are the key properties of 5-tert-butyl-3-methyl-2-propylimidazol-4-amine?
5-tert-butyl-3-methyl-2-propylimidazol-4-amine has a molecular weight of 195.31 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-3-methyl-2-propylimidazol-4-amine is sourced from PubChem (CID 62218689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).