1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole

C7H11N3 — CID 92544873

IUPAC1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole
SMILESCc1nc2c(n1C)CCN2
InChIInChI=1S/C7H11N3/c1-5-9-7-6(10(5)2)3-4-8-7/h8H,3-4H2,1-2H3
InChIKeyDIWLTZPQWPMYPS-UHFFFAOYSA-N
MW137.19 g/mol
LogP0.70
Rot. Bonds

About 1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole

1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole (PubChem CID 92544873) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole.

Molecular Properties

Compound Name1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole
PubChem CID92544873
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole
SMILESCc1nc2c(n1C)CCN2
InChIInChI=1S/C7H11N3/c1-5-9-7-6(10(5)2)3-4-8-7/h8H,3-4H2,1-2H3
InChIKeyDIWLTZPQWPMYPS-UHFFFAOYSA-N
XLogP0.70
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole?
The IUPAC name of 1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole (CID 92544873) is 1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole.
What is the SMILES notation for 1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole?
The canonical SMILES for 1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole is Cc1nc2c(n1C)CCN2.
What is the InChIKey of 1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole?
The InChIKey is DIWLTZPQWPMYPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c1-5-9-7-6(10(5)2)3-4-8-7/h8H,3-4H2,1-2H3.
What are the key properties of 1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole?
1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole has a molecular weight of 137.19 g/mol, XLogP of 0.70, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-5,6-dihydro-4H-pyrrolo[2,3-d]imidazole is sourced from PubChem (CID 92544873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).