1,5-dihydrocyclopenta[d]imidazole

C6H6N2 — CID 118403284

IUPAC1,5-dihydrocyclopenta[d]imidazole
SMILESC1=c2nc[nH]c2=CC1
InChIInChI=1S/C6H6N2/c1-2-5-6(3-1)8-4-7-5/h2-4H,1H2,(H,7,8)
InChIKeyMGCUKMYQUSLSRS-UHFFFAOYSA-N
MW106.13 g/mol
LogP-0.63
Rot. Bonds

About 1,5-dihydrocyclopenta[d]imidazole

1,5-dihydrocyclopenta[d]imidazole (PubChem CID 118403284) has the molecular formula C6H6N2 and a molecular weight of 106.13 g/mol. Its IUPAC name is 1,5-dihydrocyclopenta[d]imidazole.

Molecular Properties

Compound Name1,5-dihydrocyclopenta[d]imidazole
PubChem CID118403284
Molecular FormulaC6H6N2
Molecular Weight106.13 g/mol
Exact Mass106.05
IUPAC Name1,5-dihydrocyclopenta[d]imidazole
SMILESC1=c2nc[nH]c2=CC1
InChIInChI=1S/C6H6N2/c1-2-5-6(3-1)8-4-7-5/h2-4H,1H2,(H,7,8)
InChIKeyMGCUKMYQUSLSRS-UHFFFAOYSA-N
XLogP-0.63
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.13
LogP ≤ 5-0.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5,6-dihydro-1H-benzimidazole
CID 68269788
1,3a-Dihydrocyclopenta[d]imidazole
CID 134240726
(4E,5E)-4-ethylidene-5-propylidene-1H-imidazole
CID 134444617
(3aE,6Z,9E)-5,8-dimethyl-5,8-dihydro-1H-cycloocta[d]imidazole
CID 141930001
ethane;(4E,5E)-4-ethylidene-5-propylidene-1H-imidazole
CID 144131987
(4E,5E)-5-prop-2-enylidene-4-propylidene-1H-imidazole
CID 146656789
3-tritio-6aH-cyclopenta[d]imidazole
CID 153512649
(4E,5E)-4-butylidene-5-propylidene-1H-imidazole
CID 155108030
(4E)-5-methylidene-4-propylidene-1H-imidazole
CID 167102052
(3aE,9E)-6-methyl-1H-cycloocta[d]imidazole
CID 174018784
(4E,5E)-5-but-3-enylidene-4-ethylidene-1H-imidazole
CID 143954269
(E)-[(4E)-4-propylidene-1H-imidazol-5-ylidene]methanamine
CID 177189487

Frequently Asked Questions

What is the IUPAC name of 1,5-dihydrocyclopenta[d]imidazole?
The IUPAC name of 1,5-dihydrocyclopenta[d]imidazole (CID 118403284) is 1,5-dihydrocyclopenta[d]imidazole.
What is the SMILES notation for 1,5-dihydrocyclopenta[d]imidazole?
The canonical SMILES for 1,5-dihydrocyclopenta[d]imidazole is C1=c2nc[nH]c2=CC1.
What is the InChIKey of 1,5-dihydrocyclopenta[d]imidazole?
The InChIKey is MGCUKMYQUSLSRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N2/c1-2-5-6(3-1)8-4-7-5/h2-4H,1H2,(H,7,8).
What are the key properties of 1,5-dihydrocyclopenta[d]imidazole?
1,5-dihydrocyclopenta[d]imidazole has a molecular weight of 106.13 g/mol, XLogP of -0.63, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dihydrocyclopenta[d]imidazole is sourced from PubChem (CID 118403284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).