9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride

C20H26ClNO — CID 2892851

IUPAC9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride
SMILESCCN(CC)CCCC1(O)c2ccccc2-c2ccccc21.Cl
InChIInChI=1S/C20H25NO.ClH/c1-3-21(4-2)15-9-14-20(22)18-12-7-5-10-16(18)17-11-6-8-13-19(17)20;/h5-8,10-13,22H,3-4,9,14-15H2,1-2H3;1H
InChIKeyBRFUBDIFLJYQEE-UHFFFAOYSA-N
MW331.89 g/mol
LogP4.45
Rot. Bonds6

About 9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride

9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride (PubChem CID 2892851) has the molecular formula C20H26ClNO and a molecular weight of 331.89 g/mol. Its IUPAC name is 9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride.

Molecular Properties

Compound Name9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride
PubChem CID2892851
Molecular FormulaC20H26ClNO
Molecular Weight331.89 g/mol
Exact Mass331.17
IUPAC Name9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride
SMILESCCN(CC)CCCC1(O)c2ccccc2-c2ccccc21.Cl
InChIInChI=1S/C20H25NO.ClH/c1-3-21(4-2)15-9-14-20(22)18-12-7-5-10-16(18)17-11-6-8-13-19(17)20;/h5-8,10-13,22H,3-4,9,14-15H2,1-2H3;1H
InChIKeyBRFUBDIFLJYQEE-UHFFFAOYSA-N
XLogP4.45
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.89
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride?
The IUPAC name of 9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride (CID 2892851) is 9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride.
What is the SMILES notation for 9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride?
The canonical SMILES for 9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride is CCN(CC)CCCC1(O)c2ccccc2-c2ccccc21.Cl.
What is the InChIKey of 9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride?
The InChIKey is BRFUBDIFLJYQEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO.ClH/c1-3-21(4-2)15-9-14-20(22)18-12-7-5-10-16(18)17-11-6-8-13-19(17)20;/h5-8,10-13,22H,3-4,9,14-15H2,1-2H3;1H.
What are the key properties of 9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride?
9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride has a molecular weight of 331.89 g/mol, XLogP of 4.45, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(diethylamino)propyl]fluoren-9-ol;hydrochloride is sourced from PubChem (CID 2892851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).