5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine

C8H12N6 — CID 166610683

IUPAC5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine
SMILESCc1nc(N)c(-c2[nH]c(C)nc2N)[nH]1
InChIInChI=1S/C8H12N6/c1-3-11-5(7(9)13-3)6-8(10)14-4(2)12-6/h9-10H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyNHUQXOXWWMLLNR-UHFFFAOYSA-N
MW192.23 g/mol
LogP0.58
Rot. Bonds1

About 5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine

5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine (PubChem CID 166610683) has the molecular formula C8H12N6 and a molecular weight of 192.23 g/mol. Its IUPAC name is 5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine.

Molecular Properties

Compound Name5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine
PubChem CID166610683
Molecular FormulaC8H12N6
Molecular Weight192.23 g/mol
Exact Mass192.11
IUPAC Name5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine
SMILESCc1nc(N)c(-c2[nH]c(C)nc2N)[nH]1
InChIInChI=1S/C8H12N6/c1-3-11-5(7(9)13-3)6-8(10)14-4(2)12-6/h9-10H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyNHUQXOXWWMLLNR-UHFFFAOYSA-N
XLogP0.58
TPSA109.40 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.23
LogP ≤ 50.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine?
The IUPAC name of 5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine (CID 166610683) is 5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine.
What is the SMILES notation for 5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine?
The canonical SMILES for 5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine is Cc1nc(N)c(-c2[nH]c(C)nc2N)[nH]1.
What is the InChIKey of 5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine?
The InChIKey is NHUQXOXWWMLLNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N6/c1-3-11-5(7(9)13-3)6-8(10)14-4(2)12-6/h9-10H2,1-2H3,(H,11,13)(H,12,14).
What are the key properties of 5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine?
5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine has a molecular weight of 192.23 g/mol, XLogP of 0.58, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-amino-2-methyl-1H-imidazol-5-yl)-2-methyl-1H-imidazol-4-amine is sourced from PubChem (CID 166610683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).