N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine

C17H16N2 — CID 78909221

IUPACN-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine
SMILESc1ccc2c(c1)Cc1cc(NC3=NCCC3)ccc1-2
InChIInChI=1S/C17H16N2/c1-2-5-15-12(4-1)10-13-11-14(7-8-16(13)15)19-17-6-3-9-18-17/h1-2,4-5,7-8,11H,3,6,9-10H2,(H,18,19)
InChIKeyITWCLWCLGDNVBR-UHFFFAOYSA-N
MW248.33 g/mol
LogP3.86
Rot. Bonds1

About N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine

N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine (PubChem CID 78909221) has the molecular formula C17H16N2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine.

Molecular Properties

Compound NameN-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine
PubChem CID78909221
Molecular FormulaC17H16N2
Molecular Weight248.33 g/mol
Exact Mass248.13
IUPAC NameN-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine
SMILESc1ccc2c(c1)Cc1cc(NC3=NCCC3)ccc1-2
InChIInChI=1S/C17H16N2/c1-2-5-15-12(4-1)10-13-11-14(7-8-16(13)15)19-17-6-3-9-18-17/h1-2,4-5,7-8,11H,3,6,9-10H2,(H,18,19)
InChIKeyITWCLWCLGDNVBR-UHFFFAOYSA-N
XLogP3.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine 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-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine?
The IUPAC name of N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine (CID 78909221) is N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine.
What is the SMILES notation for N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine?
The canonical SMILES for N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine is c1ccc2c(c1)Cc1cc(NC3=NCCC3)ccc1-2.
What is the InChIKey of N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine?
The InChIKey is ITWCLWCLGDNVBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2/c1-2-5-15-12(4-1)10-13-11-14(7-8-16(13)15)19-17-6-3-9-18-17/h1-2,4-5,7-8,11H,3,6,9-10H2,(H,18,19).
What are the key properties of N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine?
N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine has a molecular weight of 248.33 g/mol, XLogP of 3.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9H-fluoren-2-yl)-3,4-dihydro-2H-pyrrol-5-amine is sourced from PubChem (CID 78909221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).