4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole

C18H15N — CID 57089967

IUPAC4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole
SMILESC=c1cc2c([nH]1)=C(C)C=C2C1C=Cc2ccccc21
InChIInChI=1S/C18H15N/c1-11-9-16(17-10-12(2)19-18(11)17)15-8-7-13-5-3-4-6-14(13)15/h3-10,15,19H,2H2,1H3
InChIKeyOUBIVQRDZFHPOV-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.80
Rot. Bonds1

About 4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole

4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole (PubChem CID 57089967) has the molecular formula C18H15N and a molecular weight of 245.32 g/mol. Its IUPAC name is 4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole.

Molecular Properties

Compound Name4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole
PubChem CID57089967
Molecular FormulaC18H15N
Molecular Weight245.32 g/mol
Exact Mass245.12
IUPAC Name4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole
SMILESC=c1cc2c([nH]1)=C(C)C=C2C1C=Cc2ccccc21
InChIInChI=1S/C18H15N/c1-11-9-16(17-10-12(2)19-18(11)17)15-8-7-13-5-3-4-6-14(13)15/h3-10,15,19H,2H2,1H3
InChIKeyOUBIVQRDZFHPOV-UHFFFAOYSA-N
XLogP2.80
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole?
The IUPAC name of 4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole (CID 57089967) is 4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole.
What is the SMILES notation for 4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole?
The canonical SMILES for 4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole is C=c1cc2c([nH]1)=C(C)C=C2C1C=Cc2ccccc21.
What is the InChIKey of 4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole?
The InChIKey is OUBIVQRDZFHPOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N/c1-11-9-16(17-10-12(2)19-18(11)17)15-8-7-13-5-3-4-6-14(13)15/h3-10,15,19H,2H2,1H3.
What are the key properties of 4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole?
4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole has a molecular weight of 245.32 g/mol, XLogP of 2.80, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-inden-1-yl)-6-methyl-2-methylidene-1H-cyclopenta[b]pyrrole is sourced from PubChem (CID 57089967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).