N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide

C17H16FNO2 — CID 77091778

IUPACN-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccc(O)c(F)c1)NC1Cc2ccccc2C1
InChIInChI=1S/C17H16FNO2/c18-15-7-11(5-6-16(15)20)8-17(21)19-14-9-12-3-1-2-4-13(12)10-14/h1-7,14,20H,8-10H2,(H,19,21)
InChIKeyBVZUHLNIJVMPBB-UHFFFAOYSA-N
MW285.32 g/mol
LogP2.36
Rot. Bonds3

About N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide

N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide (PubChem CID 77091778) has the molecular formula C17H16FNO2 and a molecular weight of 285.32 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide
PubChem CID77091778
Molecular FormulaC17H16FNO2
Molecular Weight285.32 g/mol
Exact Mass285.12
IUPAC NameN-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccc(O)c(F)c1)NC1Cc2ccccc2C1
InChIInChI=1S/C17H16FNO2/c18-15-7-11(5-6-16(15)20)8-17(21)19-14-9-12-3-1-2-4-13(12)10-14/h1-7,14,20H,8-10H2,(H,19,21)
InChIKeyBVZUHLNIJVMPBB-UHFFFAOYSA-N
XLogP2.36
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 ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide (CID 77091778) is N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide is O=C(Cc1ccc(O)c(F)c1)NC1Cc2ccccc2C1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide?
The InChIKey is BVZUHLNIJVMPBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FNO2/c18-15-7-11(5-6-16(15)20)8-17(21)19-14-9-12-3-1-2-4-13(12)10-14/h1-7,14,20H,8-10H2,(H,19,21).
What are the key properties of N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide?
N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide has a molecular weight of 285.32 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-2-yl)-2-(3-fluoro-4-hydroxyphenyl)acetamide is sourced from PubChem (CID 77091778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).