2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole

C10H15N3 — CID 118614495

IUPAC2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole
SMILESCCn1c(C2CC2)nc2c1CNC2
InChIInChI=1S/C10H15N3/c1-2-13-9-6-11-5-8(9)12-10(13)7-3-4-7/h7,11H,2-6H2,1H3
InChIKeyVJFSWZCRHLXKNR-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.38
Rot. Bonds2

About 2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole

2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole (PubChem CID 118614495) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole.

Molecular Properties

Compound Name2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole
PubChem CID118614495
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole
SMILESCCn1c(C2CC2)nc2c1CNC2
InChIInChI=1S/C10H15N3/c1-2-13-9-6-11-5-8(9)12-10(13)7-3-4-7/h7,11H,2-6H2,1H3
InChIKeyVJFSWZCRHLXKNR-UHFFFAOYSA-N
XLogP1.38
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole?
The IUPAC name of 2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole (CID 118614495) is 2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole.
What is the SMILES notation for 2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole?
The canonical SMILES for 2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole is CCn1c(C2CC2)nc2c1CNC2.
What is the InChIKey of 2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole?
The InChIKey is VJFSWZCRHLXKNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-2-13-9-6-11-5-8(9)12-10(13)7-3-4-7/h7,11H,2-6H2,1H3.
What are the key properties of 2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole?
2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole has a molecular weight of 177.25 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-ethyl-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole is sourced from PubChem (CID 118614495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).