N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide

C16H13NO3 — CID 25188167

IUPACN-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide
SMILESO=C(NCCO)c1ccc2c(c1)C(=O)c1ccccc1-2
InChIInChI=1S/C16H13NO3/c18-8-7-17-16(20)10-5-6-12-11-3-1-2-4-13(11)15(19)14(12)9-10/h1-6,9,18H,7-8H2,(H,17,20)
InChIKeyYHQHCSWDYACMIN-UHFFFAOYSA-N
MW267.28 g/mol
LogP1.62
Rot. Bonds3

About N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide

N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide (PubChem CID 25188167) has the molecular formula C16H13NO3 and a molecular weight of 267.28 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide
PubChem CID25188167
Molecular FormulaC16H13NO3
Molecular Weight267.28 g/mol
Exact Mass267.09
IUPAC NameN-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide
SMILESO=C(NCCO)c1ccc2c(c1)C(=O)c1ccccc1-2
InChIInChI=1S/C16H13NO3/c18-8-7-17-16(20)10-5-6-12-11-3-1-2-4-13(11)15(19)14(12)9-10/h1-6,9,18H,7-8H2,(H,17,20)
InChIKeyYHQHCSWDYACMIN-UHFFFAOYSA-N
XLogP1.62
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide (CID 25188167) is N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide is O=C(NCCO)c1ccc2c(c1)C(=O)c1ccccc1-2.
What is the InChIKey of N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide?
The InChIKey is YHQHCSWDYACMIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO3/c18-8-7-17-16(20)10-5-6-12-11-3-1-2-4-13(11)15(19)14(12)9-10/h1-6,9,18H,7-8H2,(H,17,20).
What are the key properties of N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide?
N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide has a molecular weight of 267.28 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-9-oxofluorene-2-carboxamide is sourced from PubChem (CID 25188167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).