5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole

C12H19N — CID 58834648

IUPAC5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole
SMILESCC(C)Cn1cc2c(c1)CC(C)C2
InChIInChI=1S/C12H19N/c1-9(2)6-13-7-11-4-10(3)5-12(11)8-13/h7-10H,4-6H2,1-3H3
InChIKeyCDUUYJDMFCAOCY-UHFFFAOYSA-N
MW177.29 g/mol
LogP2.88
Rot. Bonds2

About 5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole

5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole (PubChem CID 58834648) has the molecular formula C12H19N and a molecular weight of 177.29 g/mol. Its IUPAC name is 5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole.

Molecular Properties

Compound Name5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole
PubChem CID58834648
Molecular FormulaC12H19N
Molecular Weight177.29 g/mol
Exact Mass177.15
IUPAC Name5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole
SMILESCC(C)Cn1cc2c(c1)CC(C)C2
InChIInChI=1S/C12H19N/c1-9(2)6-13-7-11-4-10(3)5-12(11)8-13/h7-10H,4-6H2,1-3H3
InChIKeyCDUUYJDMFCAOCY-UHFFFAOYSA-N
XLogP2.88
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.29
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole?
The IUPAC name of 5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole (CID 58834648) is 5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole.
What is the SMILES notation for 5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole?
The canonical SMILES for 5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole is CC(C)Cn1cc2c(c1)CC(C)C2.
What is the InChIKey of 5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole?
The InChIKey is CDUUYJDMFCAOCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N/c1-9(2)6-13-7-11-4-10(3)5-12(11)8-13/h7-10H,4-6H2,1-3H3.
What are the key properties of 5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole?
5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole has a molecular weight of 177.29 g/mol, XLogP of 2.88, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(2-methylpropyl)-5,6-dihydro-4H-cyclopenta[c]pyrrole is sourced from PubChem (CID 58834648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).