N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide

C21H23NO3 — CID 102561260

IUPACN-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide
SMILESO=C(NC(CO)C1CCOCC1)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C21H23NO3/c23-13-20(14-7-9-25-10-8-14)22-21(24)16-5-6-19-17(12-16)11-15-3-1-2-4-18(15)19/h1-6,12,14,20,23H,7-11,13H2,(H,22,24)
InChIKeyLUUXZGPPZAVMNF-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.78
Rot. Bonds4

About N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide

N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide (PubChem CID 102561260) has the molecular formula C21H23NO3 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide.

Molecular Properties

Compound NameN-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide
PubChem CID102561260
Molecular FormulaC21H23NO3
Molecular Weight337.42 g/mol
Exact Mass337.17
IUPAC NameN-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide
SMILESO=C(NC(CO)C1CCOCC1)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C21H23NO3/c23-13-20(14-7-9-25-10-8-14)22-21(24)16-5-6-19-17(12-16)11-15-3-1-2-4-18(15)19/h1-6,12,14,20,23H,7-11,13H2,(H,22,24)
InChIKeyLUUXZGPPZAVMNF-UHFFFAOYSA-N
XLogP2.78
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-1-cyclopropylethyl]-9H-fluorene-3-carboxamide
CID 142797718
N-cyclopentyl-9H-fluorene-2-carboxamide
CID 39896867
N-(3-hydroxypropyl)-9H-fluorene-2-carboxamide
CID 78869667
N-[2-(methylamino)propyl]-9H-fluorene-2-carboxamide;hydrochloride
CID 120830258
(S)-9H-fluoren-2-yl(oxan-4-yl)methanamine
CID 171244179
1-(9H-fluoren-2-yl)-3-phenylpropane-1,3-dione
CID 132527641
[3-(9H-fluorene-2-carbonyl)phenyl]-(9H-fluoren-2-yl)methanone
CID 10552019
9H-fluorene-2-carboxamide;hydrochloride
CID 21224790
N-(2-amino-1-cyclopentylethyl)-2,3-dihydro-1-benzofuran-5-carboxamide
CID 106737365
N-[(4R)-4-hydroxyhexyl]-9H-fluorene-2-carboxamide
CID 97025616
N'-methyl-9H-fluorene-3-carbohydrazide
CID 174829565
N-(2-amino-1-cyclopropylethyl)naphthalene-2-carboxamide
CID 65189109

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide?
The IUPAC name of N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide (CID 102561260) is N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide.
What is the SMILES notation for N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide?
The canonical SMILES for N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide is O=C(NC(CO)C1CCOCC1)c1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide?
The InChIKey is LUUXZGPPZAVMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NO3/c23-13-20(14-7-9-25-10-8-14)22-21(24)16-5-6-19-17(12-16)11-15-3-1-2-4-18(15)19/h1-6,12,14,20,23H,7-11,13H2,(H,22,24).
What are the key properties of N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide?
N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 2.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-1-(oxan-4-yl)ethyl]-9H-fluorene-2-carboxamide is sourced from PubChem (CID 102561260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).