N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide

C17H16FNO2 — CID 111538143

IUPACN-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide
SMILESO=C(NC1CCc2ccc(F)cc21)C(O)c1ccccc1
InChIInChI=1S/C17H16FNO2/c18-13-8-6-11-7-9-15(14(11)10-13)19-17(21)16(20)12-4-2-1-3-5-12/h1-6,8,10,15-16,20H,7,9H2,(H,19,21)
InChIKeyMSNCRMNLXCOKFV-UHFFFAOYSA-N
MW285.32 g/mol
LogP2.66
Rot. Bonds3

About N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide

N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide (PubChem CID 111538143) has the molecular formula C17H16FNO2 and a molecular weight of 285.32 g/mol. Its IUPAC name is N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide.

Molecular Properties

Compound NameN-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide
PubChem CID111538143
Molecular FormulaC17H16FNO2
Molecular Weight285.32 g/mol
Exact Mass285.12
IUPAC NameN-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide
SMILESO=C(NC1CCc2ccc(F)cc21)C(O)c1ccccc1
InChIInChI=1S/C17H16FNO2/c18-13-8-6-11-7-9-15(14(11)10-13)19-17(21)16(20)12-4-2-1-3-5-12/h1-6,8,10,15-16,20H,7,9H2,(H,19,21)
InChIKeyMSNCRMNLXCOKFV-UHFFFAOYSA-N
XLogP2.66
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide?
The IUPAC name of N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide (CID 111538143) is N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide.
What is the SMILES notation for N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide?
The canonical SMILES for N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide is O=C(NC1CCc2ccc(F)cc21)C(O)c1ccccc1.
What is the InChIKey of N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide?
The InChIKey is MSNCRMNLXCOKFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FNO2/c18-13-8-6-11-7-9-15(14(11)10-13)19-17(21)16(20)12-4-2-1-3-5-12/h1-6,8,10,15-16,20H,7,9H2,(H,19,21).
What are the key properties of N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide?
N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide has a molecular weight of 285.32 g/mol, XLogP of 2.66, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-2-phenylacetamide is sourced from PubChem (CID 111538143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).