N-(9H-fluoren-9-yl)butan-1-imine

C17H17N — CID 14340286

IUPACN-(9H-fluoren-9-yl)butan-1-imine
SMILESCCC/C=N/C1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H17N/c1-2-3-12-18-17-15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-12,17H,2-3H2,1H3/b18-12+
InChIKeyIUQIYLSJZOVKTH-LDADJPATSA-N
MW235.33 g/mol
LogP4.63
Rot. Bonds3

About N-(9H-fluoren-9-yl)butan-1-imine

N-(9H-fluoren-9-yl)butan-1-imine (PubChem CID 14340286) has the molecular formula C17H17N and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(9H-fluoren-9-yl)butan-1-imine.

Molecular Properties

Compound NameN-(9H-fluoren-9-yl)butan-1-imine
PubChem CID14340286
Molecular FormulaC17H17N
Molecular Weight235.33 g/mol
Exact Mass235.14
IUPAC NameN-(9H-fluoren-9-yl)butan-1-imine
SMILESCCC/C=N/C1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H17N/c1-2-3-12-18-17-15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-12,17H,2-3H2,1H3/b18-12+
InChIKeyIUQIYLSJZOVKTH-LDADJPATSA-N
XLogP4.63
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

Dimefadane
CID 21760
Dimefadane hydrochloride
CID 517910
Fluoren-9-amine
CID 10671
triethyl(9H-fluoren-9-yl)azanium
CID 58610621
9H-Fluoren-9-yl isocyanate
CID 3673441
n,n-Dimethyl-9h-fluoren-9-amine
CID 265040
2-Benzylindan-1-amine
CID 46230981
N,N,9-trimethylfluoren-9-amine
CID 146656770
9-(Dimethylamino)methyleneaminofluorene
CID 58285
N,N-dimethyl-3-(4'-iodophenyl)-1-indanamine
CID 182597
N-benzyl-2-fluoro-2,3-dihydroinden-1-imine
CID 135077780
N-benzyl-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 15365679

Frequently Asked Questions

What is the IUPAC name of N-(9H-fluoren-9-yl)butan-1-imine?
The IUPAC name of N-(9H-fluoren-9-yl)butan-1-imine (CID 14340286) is N-(9H-fluoren-9-yl)butan-1-imine.
What is the SMILES notation for N-(9H-fluoren-9-yl)butan-1-imine?
The canonical SMILES for N-(9H-fluoren-9-yl)butan-1-imine is CCC/C=N/C1c2ccccc2-c2ccccc21.
What is the InChIKey of N-(9H-fluoren-9-yl)butan-1-imine?
The InChIKey is IUQIYLSJZOVKTH-LDADJPATSA-N. The full InChI is InChI=1S/C17H17N/c1-2-3-12-18-17-15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-12,17H,2-3H2,1H3/b18-12+.
What are the key properties of N-(9H-fluoren-9-yl)butan-1-imine?
N-(9H-fluoren-9-yl)butan-1-imine has a molecular weight of 235.33 g/mol, XLogP of 4.63, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9H-fluoren-9-yl)butan-1-imine is sourced from PubChem (CID 14340286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).