2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole

C10H16N4 — CID 159852492

IUPAC2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole
SMILESCc1cnc(C)[nH]1.Cc1nc[nH]c1C
InChIInChI=1S/2C5H8N2/c1-4-5(2)7-3-6-4;1-4-3-6-5(2)7-4/h2*3H,1-2H3,(H,6,7)
InChIKeyNQCPXRORNYAVKQ-UHFFFAOYSA-N
MW192.27 g/mol
LogP2.05
Rot. Bonds

About 2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole

2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole (PubChem CID 159852492) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole.

Molecular Properties

Compound Name2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole
PubChem CID159852492
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole
SMILESCc1cnc(C)[nH]1.Cc1nc[nH]c1C
InChIInChI=1S/2C5H8N2/c1-4-5(2)7-3-6-4;1-4-3-6-5(2)7-4/h2*3H,1-2H3,(H,6,7)
InChIKeyNQCPXRORNYAVKQ-UHFFFAOYSA-N
XLogP2.05
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole?
The IUPAC name of 2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole (CID 159852492) is 2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole.
What is the SMILES notation for 2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole?
The canonical SMILES for 2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole is Cc1cnc(C)[nH]1.Cc1nc[nH]c1C.
What is the InChIKey of 2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole?
The InChIKey is NQCPXRORNYAVKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H8N2/c1-4-5(2)7-3-6-4;1-4-3-6-5(2)7-4/h2*3H,1-2H3,(H,6,7).
What are the key properties of 2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole?
2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole has a molecular weight of 192.27 g/mol, XLogP of 2.05, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole is sourced from PubChem (CID 159852492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).