2-(9H-fluoren-9-yl)-1H-pyrrole

C17H13N — CID 57142486

IUPAC2-(9H-fluoren-9-yl)-1H-pyrrole
SMILESc1c[nH]c(C2c3ccccc3-c3ccccc32)c1
InChIInChI=1S/C17H13N/c1-3-8-14-12(6-1)13-7-2-4-9-15(13)17(14)16-10-5-11-18-16/h1-11,17-18H
InChIKeyJNAYKKZYCLKJID-UHFFFAOYSA-N
MW231.30 g/mol
LogP4.18
Rot. Bonds1

About 2-(9H-fluoren-9-yl)-1H-pyrrole

2-(9H-fluoren-9-yl)-1H-pyrrole (PubChem CID 57142486) has the molecular formula C17H13N and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-(9H-fluoren-9-yl)-1H-pyrrole.

Molecular Properties

Compound Name2-(9H-fluoren-9-yl)-1H-pyrrole
PubChem CID57142486
Molecular FormulaC17H13N
Molecular Weight231.30 g/mol
Exact Mass231.10
IUPAC Name2-(9H-fluoren-9-yl)-1H-pyrrole
SMILESc1c[nH]c(C2c3ccccc3-c3ccccc32)c1
InChIInChI=1S/C17H13N/c1-3-8-14-12(6-1)13-7-2-4-9-15(13)17(14)16-10-5-11-18-16/h1-11,17-18H
InChIKeyJNAYKKZYCLKJID-UHFFFAOYSA-N
XLogP4.18
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

5-(9H-fluoren-9-yl)-1H-pyrazole
CID 68627258
9-phenyl-9H-fluorene
CID 13091
2-[(3R)-3-(1H-pyrrol-2-yl)-3H-1,2,4-triazol-5-yl]aniline
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2-(oxiran-2-yl)-1H-pyrrole
CID 57031203
8-(1H-indol-3-yl)-11-azatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2,4,6,9,12,14-heptaene
CID 139526372
2-(1H-pyrrol-2-yl)-3,1-benzoxathiin-4-one
CID 176765867
2-cyclononyl-1H-pyrrole
CID 173176738
2-cyclotetradecyl-1H-pyrrole
CID 173176326
methane;1H-pyrrol-2-ylmethanamine
CID 162272370
9-fluoro-9H-fluorene
CID 12685099
2-cyclopentyl-1-oxo-3-(1H-pyrrol-2-yl)-3,4-dihydroisoquinoline-4-carboxylic acid
CID 82579673
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(1H-pyrrol-2-yl)propanoic acid
CID 164517313

Frequently Asked Questions

What is the IUPAC name of 2-(9H-fluoren-9-yl)-1H-pyrrole?
The IUPAC name of 2-(9H-fluoren-9-yl)-1H-pyrrole (CID 57142486) is 2-(9H-fluoren-9-yl)-1H-pyrrole.
What is the SMILES notation for 2-(9H-fluoren-9-yl)-1H-pyrrole?
The canonical SMILES for 2-(9H-fluoren-9-yl)-1H-pyrrole is c1c[nH]c(C2c3ccccc3-c3ccccc32)c1.
What is the InChIKey of 2-(9H-fluoren-9-yl)-1H-pyrrole?
The InChIKey is JNAYKKZYCLKJID-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N/c1-3-8-14-12(6-1)13-7-2-4-9-15(13)17(14)16-10-5-11-18-16/h1-11,17-18H.
What are the key properties of 2-(9H-fluoren-9-yl)-1H-pyrrole?
2-(9H-fluoren-9-yl)-1H-pyrrole has a molecular weight of 231.30 g/mol, XLogP of 4.18, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9H-fluoren-9-yl)-1H-pyrrole is sourced from PubChem (CID 57142486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).