9-hexyl-9H-fluorene-2,7-diamine

C19H24N2 — CID 66850655

IUPAC9-hexyl-9H-fluorene-2,7-diamine
SMILESCCCCCCC1c2cc(N)ccc2-c2ccc(N)cc21
InChIInChI=1S/C19H24N2/c1-2-3-4-5-6-15-18-11-13(20)7-9-16(18)17-10-8-14(21)12-19(15)17/h7-12,15H,2-6,20-21H2,1H3
InChIKeyFHJRYFHTTJVYDJ-UHFFFAOYSA-N
MW280.42 g/mol
LogP4.93
Rot. Bonds5

About 9-hexyl-9H-fluorene-2,7-diamine

9-hexyl-9H-fluorene-2,7-diamine (PubChem CID 66850655) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is 9-hexyl-9H-fluorene-2,7-diamine.

Molecular Properties

Compound Name9-hexyl-9H-fluorene-2,7-diamine
PubChem CID66850655
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name9-hexyl-9H-fluorene-2,7-diamine
SMILESCCCCCCC1c2cc(N)ccc2-c2ccc(N)cc21
InChIInChI=1S/C19H24N2/c1-2-3-4-5-6-15-18-11-13(20)7-9-16(18)17-10-8-14(21)12-19(15)17/h7-12,15H,2-6,20-21H2,1H3
InChIKeyFHJRYFHTTJVYDJ-UHFFFAOYSA-N
XLogP4.93
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

Benzidine
CID 7111
2-Aminofluorene
CID 1539
3,4-Dimethylaniline
CID 7248
2-Nitroso-9H-fluorene
CID 17271
N-hydroxy-2-aminofluorene
CID 5895
4,4'-Ethylenedianiline
CID 12138
3-Aminofluoranthene
CID 17599
2,7-Diaminofluorene
CID 10679
(R)-6,6'-Dimethyl-1,1'-biphenyl-2,2'-diyldiamine
CID 882241
4,4'-(9-Fluorenylidene)dianiline
CID 631552
5-Aminoacenaphthene
CID 62547
Fluoren-1-amine
CID 22817

Frequently Asked Questions

What is the IUPAC name of 9-hexyl-9H-fluorene-2,7-diamine?
The IUPAC name of 9-hexyl-9H-fluorene-2,7-diamine (CID 66850655) is 9-hexyl-9H-fluorene-2,7-diamine.
What is the SMILES notation for 9-hexyl-9H-fluorene-2,7-diamine?
The canonical SMILES for 9-hexyl-9H-fluorene-2,7-diamine is CCCCCCC1c2cc(N)ccc2-c2ccc(N)cc21.
What is the InChIKey of 9-hexyl-9H-fluorene-2,7-diamine?
The InChIKey is FHJRYFHTTJVYDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-2-3-4-5-6-15-18-11-13(20)7-9-16(18)17-10-8-14(21)12-19(15)17/h7-12,15H,2-6,20-21H2,1H3.
What are the key properties of 9-hexyl-9H-fluorene-2,7-diamine?
9-hexyl-9H-fluorene-2,7-diamine has a molecular weight of 280.42 g/mol, XLogP of 4.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-hexyl-9H-fluorene-2,7-diamine is sourced from PubChem (CID 66850655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).