4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol

C19H23NO — CID 106840519

IUPAC4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol
SMILESCC(NCCCCO)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C19H23NO/c1-14(20-10-4-5-11-21)15-8-9-19-17(12-15)13-16-6-2-3-7-18(16)19/h2-3,6-9,12,14,20-21H,4-5,10-11,13H2,1H3
InChIKeyZTDURQBLUHCVGO-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.68
Rot. Bonds6

About 4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol

4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol (PubChem CID 106840519) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol.

Molecular Properties

Compound Name4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol
PubChem CID106840519
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol
SMILESCC(NCCCCO)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C19H23NO/c1-14(20-10-4-5-11-21)15-8-9-19-17(12-15)13-16-6-2-3-7-18(16)19/h2-3,6-9,12,14,20-21H,4-5,10-11,13H2,1H3
InChIKeyZTDURQBLUHCVGO-UHFFFAOYSA-N
XLogP3.68
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine
CID 16776550
1-[1-(9H-fluoren-2-yl)ethylamino]propan-2-ol
CID 43499372
2-[1-(9H-fluoren-2-yl)ethylamino]-N-methylacetamide
CID 43310464
N-[1-(9H-fluoren-2-yl)ethyl]propan-2-amine
CID 43095190
3-[1-(9H-fluoren-2-yl)ethylamino]-2-methylpropanenitrile
CID 62645655
5-[1-(3-methylphenyl)ethylamino]pentan-1-ol
CID 107303118
5-[[(1R)-1-(3-methylphenyl)ethyl]amino]pentan-1-ol
CID 81360778
4-[[(1S)-1-(4-methylphenyl)ethyl]amino]butan-1-ol
CID 81356672
4-[[(1R)-1-(4-methylphenyl)ethyl]amino]butan-1-ol
CID 81356259
4-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]butan-1-ol
CID 106840592
3-[[(1S)-1-(3-chlorophenyl)ethyl]amino]propan-1-ol
CID 28715339
2-amino-1-(9H-fluoren-2-yl)ethanol
CID 14023206

Frequently Asked Questions

What is the IUPAC name of 4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol?
The IUPAC name of 4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol (CID 106840519) is 4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol.
What is the SMILES notation for 4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol?
The canonical SMILES for 4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol is CC(NCCCCO)c1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of 4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol?
The InChIKey is ZTDURQBLUHCVGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-14(20-10-4-5-11-21)15-8-9-19-17(12-15)13-16-6-2-3-7-18(16)19/h2-3,6-9,12,14,20-21H,4-5,10-11,13H2,1H3.
What are the key properties of 4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol?
4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol has a molecular weight of 281.40 g/mol, XLogP of 3.68, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(9H-fluoren-2-yl)ethylamino]butan-1-ol is sourced from PubChem (CID 106840519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).