6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine

C8H10N6 — CID 89415685

IUPAC6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine
SMILESCc1c(N)nc(N)nc1-c1cnc[nH]1
InChIInChI=1S/C8H10N6/c1-4-6(5-2-11-3-12-5)13-8(10)14-7(4)9/h2-3H,1H3,(H,11,12)(H4,9,10,13,14)
InChIKeyNUWBVXGLFMEANN-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.34
Rot. Bonds1

About 6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine

6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine (PubChem CID 89415685) has the molecular formula C8H10N6 and a molecular weight of 190.21 g/mol. Its IUPAC name is 6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine
PubChem CID89415685
Molecular FormulaC8H10N6
Molecular Weight190.21 g/mol
Exact Mass190.10
IUPAC Name6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine
SMILESCc1c(N)nc(N)nc1-c1cnc[nH]1
InChIInChI=1S/C8H10N6/c1-4-6(5-2-11-3-12-5)13-8(10)14-7(4)9/h2-3H,1H3,(H,11,12)(H4,9,10,13,14)
InChIKeyNUWBVXGLFMEANN-UHFFFAOYSA-N
XLogP0.34
TPSA106.50 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine?
The IUPAC name of 6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine (CID 89415685) is 6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine.
What is the SMILES notation for 6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine?
The canonical SMILES for 6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine is Cc1c(N)nc(N)nc1-c1cnc[nH]1.
What is the InChIKey of 6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine?
The InChIKey is NUWBVXGLFMEANN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N6/c1-4-6(5-2-11-3-12-5)13-8(10)14-7(4)9/h2-3H,1H3,(H,11,12)(H4,9,10,13,14).
What are the key properties of 6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine?
6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine has a molecular weight of 190.21 g/mol, XLogP of 0.34, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1H-imidazol-5-yl)-5-methylpyrimidine-2,4-diamine is sourced from PubChem (CID 89415685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).