2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine

C12H19N5 — CID 62219674

IUPAC2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine
SMILESCn1cc(-c2nc(C(C)(C)C)n(C)c2N)cn1
InChIInChI=1S/C12H19N5/c1-12(2,3)11-15-9(10(13)17(11)5)8-6-14-16(4)7-8/h6-7H,13H2,1-5H3
InChIKeyRIHFUMUZWNPXBD-UHFFFAOYSA-N
MW233.32 g/mol
LogP1.70
Rot. Bonds1

About 2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine

2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine (PubChem CID 62219674) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is 2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine.

Molecular Properties

Compound Name2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine
PubChem CID62219674
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC Name2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine
SMILESCn1cc(-c2nc(C(C)(C)C)n(C)c2N)cn1
InChIInChI=1S/C12H19N5/c1-12(2,3)11-15-9(10(13)17(11)5)8-6-14-16(4)7-8/h6-7H,13H2,1-5H3
InChIKeyRIHFUMUZWNPXBD-UHFFFAOYSA-N
XLogP1.70
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-butyl-2-tert-butyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine
CID 62220408
3-methyl-5-(1-methylpyrazol-4-yl)-2-propylimidazol-4-amine
CID 62219046
2-tert-butyl-5-(6-methoxy-3-pyridinyl)-3-methylimidazol-4-amine
CID 114938274
2-tert-butyl-4-(1-propylpyrazol-4-yl)imidazole-1,5-diamine
CID 103572934
2-tert-butyl-N,5-dimethyl-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 80974722
2-tert-butyl-5-ethyl-3-methylimidazol-4-amine
CID 62218986
6-N,6-N-dimethyl-2-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3,6-diamine
CID 55248780
3-cyclopropyl-5-(1-methylpyrazol-4-yl)-2-phenylimidazol-4-amine
CID 62222615
5-(1-methylpyrazol-4-yl)-2-propan-2-yl-3-prop-2-enylimidazol-4-amine
CID 62218217
5-(1-methylpyrazol-4-yl)-3-prop-2-enyl-2-propylimidazol-4-amine
CID 62220498
1-tert-butyl-5-chloro-4-fluoro-3-(1-methylpyrazol-4-yl)pyrazole
CID 153409958
5-(1-methylpyrazol-4-yl)-4-N-propylpyrimidine-2,4-diamine
CID 142345155

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine?
The IUPAC name of 2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine (CID 62219674) is 2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine.
What is the SMILES notation for 2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine?
The canonical SMILES for 2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine is Cn1cc(-c2nc(C(C)(C)C)n(C)c2N)cn1.
What is the InChIKey of 2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine?
The InChIKey is RIHFUMUZWNPXBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c1-12(2,3)11-15-9(10(13)17(11)5)8-6-14-16(4)7-8/h6-7H,13H2,1-5H3.
What are the key properties of 2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine?
2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine has a molecular weight of 233.32 g/mol, XLogP of 1.70, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-3-methyl-5-(1-methylpyrazol-4-yl)imidazol-4-amine is sourced from PubChem (CID 62219674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).