2-methyl-1,5-dihydrocyclopenta[d]imidazole

C7H8N2 — CID 23558742

IUPAC2-methyl-1,5-dihydrocyclopenta[d]imidazole
SMILESCc1nc2c([nH]1)=CCC=2
InChIInChI=1S/C7H8N2/c1-5-8-6-3-2-4-7(6)9-5/h3-4H,2H2,1H3,(H,8,9)
InChIKeyUBHHHRPLSSHNNZ-UHFFFAOYSA-N
MW120.15 g/mol
LogP-0.32
Rot. Bonds

About 2-methyl-1,5-dihydrocyclopenta[d]imidazole

2-methyl-1,5-dihydrocyclopenta[d]imidazole (PubChem CID 23558742) has the molecular formula C7H8N2 and a molecular weight of 120.15 g/mol. Its IUPAC name is 2-methyl-1,5-dihydrocyclopenta[d]imidazole.

Molecular Properties

Compound Name2-methyl-1,5-dihydrocyclopenta[d]imidazole
PubChem CID23558742
Molecular FormulaC7H8N2
Molecular Weight120.15 g/mol
Exact Mass120.07
IUPAC Name2-methyl-1,5-dihydrocyclopenta[d]imidazole
SMILESCc1nc2c([nH]1)=CCC=2
InChIInChI=1S/C7H8N2/c1-5-8-6-3-2-4-7(6)9-5/h3-4H,2H2,1H3,(H,8,9)
InChIKeyUBHHHRPLSSHNNZ-UHFFFAOYSA-N
XLogP-0.32
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.15
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,5-dihydrocyclopenta[d]imidazole?
The IUPAC name of 2-methyl-1,5-dihydrocyclopenta[d]imidazole (CID 23558742) is 2-methyl-1,5-dihydrocyclopenta[d]imidazole.
What is the SMILES notation for 2-methyl-1,5-dihydrocyclopenta[d]imidazole?
The canonical SMILES for 2-methyl-1,5-dihydrocyclopenta[d]imidazole is Cc1nc2c([nH]1)=CCC=2.
What is the InChIKey of 2-methyl-1,5-dihydrocyclopenta[d]imidazole?
The InChIKey is UBHHHRPLSSHNNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2/c1-5-8-6-3-2-4-7(6)9-5/h3-4H,2H2,1H3,(H,8,9).
What are the key properties of 2-methyl-1,5-dihydrocyclopenta[d]imidazole?
2-methyl-1,5-dihydrocyclopenta[d]imidazole has a molecular weight of 120.15 g/mol, XLogP of -0.32, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,5-dihydrocyclopenta[d]imidazole is sourced from PubChem (CID 23558742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).