N-benzyl-9-hydroxyfluorene-9-carboxamide

C21H17NO2 — CID 21240344

IUPACN-benzyl-9-hydroxyfluorene-9-carboxamide
SMILESO=C(NCc1ccccc1)C1(O)c2ccccc2-c2ccccc21
InChIInChI=1S/C21H17NO2/c23-20(22-14-15-8-2-1-3-9-15)21(24)18-12-6-4-10-16(18)17-11-5-7-13-19(17)21/h1-13,24H,14H2,(H,22,23)
InChIKeyZOEPKKKDDYCLME-UHFFFAOYSA-N
MW315.37 g/mol
LogP3.22
Rot. Bonds3

About N-benzyl-9-hydroxyfluorene-9-carboxamide

N-benzyl-9-hydroxyfluorene-9-carboxamide (PubChem CID 21240344) has the molecular formula C21H17NO2 and a molecular weight of 315.37 g/mol. Its IUPAC name is N-benzyl-9-hydroxyfluorene-9-carboxamide.

Molecular Properties

Compound NameN-benzyl-9-hydroxyfluorene-9-carboxamide
PubChem CID21240344
Molecular FormulaC21H17NO2
Molecular Weight315.37 g/mol
Exact Mass315.13
IUPAC NameN-benzyl-9-hydroxyfluorene-9-carboxamide
SMILESO=C(NCc1ccccc1)C1(O)c2ccccc2-c2ccccc21
InChIInChI=1S/C21H17NO2/c23-20(22-14-15-8-2-1-3-9-15)21(24)18-12-6-4-10-16(18)17-11-5-7-13-19(17)21/h1-13,24H,14H2,(H,22,23)
InChIKeyZOEPKKKDDYCLME-UHFFFAOYSA-N
XLogP3.22
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-9-hydroxyfluorene-9-carboxamide?
The IUPAC name of N-benzyl-9-hydroxyfluorene-9-carboxamide (CID 21240344) is N-benzyl-9-hydroxyfluorene-9-carboxamide.
What is the SMILES notation for N-benzyl-9-hydroxyfluorene-9-carboxamide?
The canonical SMILES for N-benzyl-9-hydroxyfluorene-9-carboxamide is O=C(NCc1ccccc1)C1(O)c2ccccc2-c2ccccc21.
What is the InChIKey of N-benzyl-9-hydroxyfluorene-9-carboxamide?
The InChIKey is ZOEPKKKDDYCLME-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17NO2/c23-20(22-14-15-8-2-1-3-9-15)21(24)18-12-6-4-10-16(18)17-11-5-7-13-19(17)21/h1-13,24H,14H2,(H,22,23).
What are the key properties of N-benzyl-9-hydroxyfluorene-9-carboxamide?
N-benzyl-9-hydroxyfluorene-9-carboxamide has a molecular weight of 315.37 g/mol, XLogP of 3.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-9-hydroxyfluorene-9-carboxamide is sourced from PubChem (CID 21240344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).