2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride

C20H24ClNO2 — CID 11058

IUPAC2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride
SMILESCCN(CC)CCOC(=O)C1c2ccccc2-c2ccccc21.Cl
InChIInChI=1S/C20H23NO2.ClH/c1-3-21(4-2)13-14-23-20(22)19-17-11-7-5-9-15(17)16-10-6-8-12-18(16)19;/h5-12,19H,3-4,13-14H2,1-2H3;1H
InChIKeyTYFLIJAGRULBIS-UHFFFAOYSA-N
MW345.87 g/mol
LogP4.11
Rot. Bonds6

About 2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride

2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride (PubChem CID 11058) has the molecular formula C20H24ClNO2 and a molecular weight of 345.87 g/mol. Its IUPAC name is 2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride.

Molecular Properties

Compound Name2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride
PubChem CID11058
Molecular FormulaC20H24ClNO2
Molecular Weight345.87 g/mol
Exact Mass345.15
IUPAC Name2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride
SMILESCCN(CC)CCOC(=O)C1c2ccccc2-c2ccccc21.Cl
InChIInChI=1S/C20H23NO2.ClH/c1-3-21(4-2)13-14-23-20(22)19-17-11-7-5-9-15(17)16-10-6-8-12-18(16)19;/h5-12,19H,3-4,13-14H2,1-2H3;1H
InChIKeyTYFLIJAGRULBIS-UHFFFAOYSA-N
XLogP4.11
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.87
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(diethylamino)ethyl 10-methyl-9H-acridine-9-carboxylate;hydrochloride
CID 138401573
3-(dibutylamino)propyl 9H-fluorene-9-carboxylate;hydrochloride
CID 138400608
2-(9H-fluorene-9-carbonyloxy)ethanesulfonic acid
CID 121308516
2-hydroxyethyl 9H-fluorene-9-carboxylate;2-methylprop-2-enoic acid
CID 70268777
2-(2-methylpropylamino)ethyl 9H-fluorene-9-carboxylate
CID 23621651
2-[di(propan-2-yl)amino]ethyl 9H-xanthene-9-carboxylate;hydrochloride
CID 169438672
[2-[2-(diethylamino)ethoxycarbonyl]phenyl] 2-hydroxybenzoate;hydrochloride
CID 168984736
2-(diethylamino)ethyl 2-(2-oxopropyl)benzoate;hydrochloride
CID 159121513
2-(diethylamino)ethyl 4-(1,3-dioxoisoindol-2-yl)benzoate
CID 168519961
2-(diethylamino)ethyl 4-aminobenzoate;hectahydrochloride
CID 173229201
bis[2-(diethylamino)ethyl] 2,3-diphenylbutanedioate
CID 3060795
2-(diethylamino)ethyl acridine-9-carboxylate;hydrochloride
CID 138400827

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride?
The IUPAC name of 2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride (CID 11058) is 2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride.
What is the SMILES notation for 2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride?
The canonical SMILES for 2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride is CCN(CC)CCOC(=O)C1c2ccccc2-c2ccccc21.Cl.
What is the InChIKey of 2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride?
The InChIKey is TYFLIJAGRULBIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2.ClH/c1-3-21(4-2)13-14-23-20(22)19-17-11-7-5-9-15(17)16-10-6-8-12-18(16)19;/h5-12,19H,3-4,13-14H2,1-2H3;1H.
What are the key properties of 2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride?
2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride has a molecular weight of 345.87 g/mol, XLogP of 4.11, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)ethyl 9H-fluorene-9-carboxylate;hydrochloride is sourced from PubChem (CID 11058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).