5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine

C11H21N3 — CID 62226713

IUPAC5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine
SMILESCCC(C)c1nc(C)n(C(C)C)c1N
InChIInChI=1S/C11H21N3/c1-6-8(4)10-11(12)14(7(2)3)9(5)13-10/h7-8H,6,12H2,1-5H3
InChIKeyDCCIEOSDSLOEBG-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.87
Rot. Bonds3

About 5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine

5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine (PubChem CID 62226713) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine.

Molecular Properties

Compound Name5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine
PubChem CID62226713
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine
SMILESCCC(C)c1nc(C)n(C(C)C)c1N
InChIInChI=1S/C11H21N3/c1-6-8(4)10-11(12)14(7(2)3)9(5)13-10/h7-8H,6,12H2,1-5H3
InChIKeyDCCIEOSDSLOEBG-UHFFFAOYSA-N
XLogP2.87
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-5-pentan-2-yl-3-propylimidazol-4-amine
CID 62226709
5-butan-2-yl-3-tert-butyl-2-propan-2-ylimidazol-4-amine
CID 62219623
2-methyl-5-(2-phenylpropyl)-3-propan-2-ylimidazol-4-amine
CID 62226150
2-methyl-5-pentan-2-yl-3-prop-2-ynylimidazol-4-amine
CID 62226185
6-bromo-2-butan-2-yl-8-methylimidazo[1,2-a]pyridin-3-amine
CID 83171128
6-[(2R)-butan-2-yl]-5-methylpyrazin-2-amine
CID 167607500
3-butyl-2-methyl-5-(4-methylpentan-2-yl)imidazol-4-amine
CID 114201111
5-butan-2-yl-2-cyclopropyl-3-propylimidazol-4-amine
CID 62220557
2-methyl-3-propan-2-yl-5-(2,4,6-trimethylphenyl)imidazol-4-amine
CID 62223948
5-(2,3-dimethylphenyl)-2-methyl-3-propan-2-ylimidazol-4-amine
CID 55047778
4-butan-2-yl-5-chloro-1,3-thiazol-2-amine
CID 142119110
2-butan-2-yl-5-methyl-1-propan-2-ylpyrrole
CID 91672106

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine?
The IUPAC name of 5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine (CID 62226713) is 5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine.
What is the SMILES notation for 5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine?
The canonical SMILES for 5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine is CCC(C)c1nc(C)n(C(C)C)c1N.
What is the InChIKey of 5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine?
The InChIKey is DCCIEOSDSLOEBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-6-8(4)10-11(12)14(7(2)3)9(5)13-10/h7-8H,6,12H2,1-5H3.
What are the key properties of 5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine?
5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine has a molecular weight of 195.31 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-2-methyl-3-propan-2-ylimidazol-4-amine is sourced from PubChem (CID 62226713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).