N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine

C10H16N2O — CID 82600698

IUPACN-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine
SMILESCONCc1c[nH]c2c1CC(C)C2
InChIInChI=1S/C10H16N2O/c1-7-3-9-8(6-12-13-2)5-11-10(9)4-7/h5,7,11-12H,3-4,6H2,1-2H3
InChIKeyFQXXYWZTMTXQAL-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.40
Rot. Bonds3

About N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine

N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine (PubChem CID 82600698) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine.

Molecular Properties

Compound NameN-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine
PubChem CID82600698
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC NameN-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine
SMILESCONCc1c[nH]c2c1CC(C)C2
InChIInChI=1S/C10H16N2O/c1-7-3-9-8(6-12-13-2)5-11-10(9)4-7/h5,7,11-12H,3-4,6H2,1-2H3
InChIKeyFQXXYWZTMTXQAL-UHFFFAOYSA-N
XLogP1.40
TPSA37.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine 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 N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine?
The IUPAC name of N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine (CID 82600698) is N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine.
What is the SMILES notation for N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine?
The canonical SMILES for N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine is CONCc1c[nH]c2c1CC(C)C2.
What is the InChIKey of N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine?
The InChIKey is FQXXYWZTMTXQAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-7-3-9-8(6-12-13-2)5-11-10(9)4-7/h5,7,11-12H,3-4,6H2,1-2H3.
What are the key properties of N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine?
N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine has a molecular weight of 180.25 g/mol, XLogP of 1.40, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-1-(5-methyl-1,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine is sourced from PubChem (CID 82600698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).