N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine

C9H14N2 — CID 158470129

IUPACN-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine
SMILESCNCC1=C2CCCC2=NC1
InChIInChI=1S/C9H14N2/c1-10-5-7-6-11-9-4-2-3-8(7)9/h10H,2-6H2,1H3
InChIKeyAAFRYOAXPPOYRF-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.14
Rot. Bonds2

About N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine

N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine (PubChem CID 158470129) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine
PubChem CID158470129
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC NameN-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine
SMILESCNCC1=C2CCCC2=NC1
InChIInChI=1S/C9H14N2/c1-10-5-7-6-11-9-4-2-3-8(7)9/h10H,2-6H2,1H3
InChIKeyAAFRYOAXPPOYRF-UHFFFAOYSA-N
XLogP1.14
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine?
The IUPAC name of N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine (CID 158470129) is N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine?
The canonical SMILES for N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine is CNCC1=C2CCCC2=NC1.
What is the InChIKey of N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine?
The InChIKey is AAFRYOAXPPOYRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-10-5-7-6-11-9-4-2-3-8(7)9/h10H,2-6H2,1H3.
What are the key properties of N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine?
N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine has a molecular weight of 150.22 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2,4,5,6-tetrahydrocyclopenta[b]pyrrol-3-yl)methanamine is sourced from PubChem (CID 158470129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).