5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine

C7H15N3 — CID 143040281

IUPAC5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine
SMILESCN1CC2CNCC2(N)C1
InChIInChI=1S/C7H15N3/c1-10-3-6-2-9-4-7(6,8)5-10/h6,9H,2-5,8H2,1H3
InChIKeyXLVAGMWBNADXLM-UHFFFAOYSA-N
MW141.22 g/mol
LogP-1.15
Rot. Bonds

About 5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine

5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine (PubChem CID 143040281) has the molecular formula C7H15N3 and a molecular weight of 141.22 g/mol. Its IUPAC name is 5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine.

Molecular Properties

Compound Name5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine
PubChem CID143040281
Molecular FormulaC7H15N3
Molecular Weight141.22 g/mol
Exact Mass141.13
IUPAC Name5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine
SMILESCN1CC2CNCC2(N)C1
InChIInChI=1S/C7H15N3/c1-10-3-6-2-9-4-7(6,8)5-10/h6,9H,2-5,8H2,1H3
InChIKeyXLVAGMWBNADXLM-UHFFFAOYSA-N
XLogP-1.15
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.22
LogP ≤ 5-1.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine?
The IUPAC name of 5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine (CID 143040281) is 5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine.
What is the SMILES notation for 5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine?
The canonical SMILES for 5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine is CN1CC2CNCC2(N)C1.
What is the InChIKey of 5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine?
The InChIKey is XLVAGMWBNADXLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3/c1-10-3-6-2-9-4-7(6,8)5-10/h6,9H,2-5,8H2,1H3.
What are the key properties of 5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine?
5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine has a molecular weight of 141.22 g/mol, XLogP of -1.15, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-3a-amine is sourced from PubChem (CID 143040281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).