2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole

C9H12N2 — CID 82417631

IUPAC2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole
SMILESc1c(C2CC2)[nH]c2c1CNC2
InChIInChI=1S/C9H12N2/c1-2-6(1)8-3-7-4-10-5-9(7)11-8/h3,6,10-11H,1-2,4-5H2
InChIKeyGXCDYAIBSCCLSJ-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.50
Rot. Bonds1

About 2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole

2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole (PubChem CID 82417631) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole.

Molecular Properties

Compound Name2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole
PubChem CID82417631
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole
SMILESc1c(C2CC2)[nH]c2c1CNC2
InChIInChI=1S/C9H12N2/c1-2-6(1)8-3-7-4-10-5-9(7)11-8/h3,6,10-11H,1-2,4-5H2
InChIKeyGXCDYAIBSCCLSJ-UHFFFAOYSA-N
XLogP1.50
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclohexyl-4,5,6,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine
CID 82396461
2-methyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole
CID 82418938
2-cycloheptyl-4,5,6,7-tetrahydro-1H-indole
CID 173178556
2-cyclopentyl-1,4,6,7-tetrahydropyrano[4,3-b]pyrrole
CID 82403214
2-oxo-1,5,6,7-tetrahydropyrrolo[3,4-b]pyridine-3-carboxamide;hydrochloride
CID 91623841
2-cyclohexyl-5-methyl-1,4,6,7-tetrahydropyrrolo[3,2-c]pyridine
CID 96609619
1,5,6,7-tetrahydropyrrolo[3,4-b]pyridin-2-one;dihydrochloride
CID 155943618
4-cyclopropyl-2,3-dihydro-1H-isoindol-5-amine
CID 168888894
2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole-3-carboxylic acid
CID 82402792
4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine-2-carboxylic acid
CID 77174580
4-cyclobutyl-6-cyclopropyl-1H-pyrimidin-2-one
CID 130056140
4-amino-6-[4-(aminomethyl)cyclohexyl]-1H-pyrimidin-2-one
CID 83857323

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole?
The IUPAC name of 2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole (CID 82417631) is 2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole.
What is the SMILES notation for 2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole?
The canonical SMILES for 2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole is c1c(C2CC2)[nH]c2c1CNC2.
What is the InChIKey of 2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole?
The InChIKey is GXCDYAIBSCCLSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-2-6(1)8-3-7-4-10-5-9(7)11-8/h3,6,10-11H,1-2,4-5H2.
What are the key properties of 2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole?
2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole has a molecular weight of 148.21 g/mol, XLogP of 1.50, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1,4,5,6-tetrahydropyrrolo[3,4-b]pyrrole is sourced from PubChem (CID 82417631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).