N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide

C17H15FN2O2 — CID 155516405

IUPACN-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide
SMILESO=C(NCCc1c[nH]c2ccc(F)cc12)c1ccccc1O
InChIInChI=1S/C17H15FN2O2/c18-12-5-6-15-14(9-12)11(10-20-15)7-8-19-17(22)13-3-1-2-4-16(13)21/h1-6,9-10,20-21H,7-8H2,(H,19,22)
InChIKeySXZIDDGDFXJKEC-UHFFFAOYSA-N
MW298.32 g/mol
LogP2.99
Rot. Bonds4

About N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide

N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide (PubChem CID 155516405) has the molecular formula C17H15FN2O2 and a molecular weight of 298.32 g/mol. Its IUPAC name is N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide
PubChem CID155516405
Molecular FormulaC17H15FN2O2
Molecular Weight298.32 g/mol
Exact Mass298.11
IUPAC NameN-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide
SMILESO=C(NCCc1c[nH]c2ccc(F)cc12)c1ccccc1O
InChIInChI=1S/C17H15FN2O2/c18-12-5-6-15-14(9-12)11(10-20-15)7-8-19-17(22)13-3-1-2-4-16(13)21/h1-6,9-10,20-21H,7-8H2,(H,19,22)
InChIKeySXZIDDGDFXJKEC-UHFFFAOYSA-N
XLogP2.99
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.32
LogP ≤ 52.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-4-fluoro-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 26245347
5-fluoro-2-(hydroxymethyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 175363337
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-(3-fluorophenyl)acetamide
CID 110731491
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]furan-2-carboxamide
CID 110731470
2-(2-fluoroanilino)-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 162373909
2,6-difluoro-N-[2-(6-fluoro-1H-indol-3-yl)ethyl]benzamide
CID 49408660
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-4-(trifluoromethyl)benzamide
CID 113083594
phenyl N-[2-(5-fluoro-1H-indol-3-yl)ethyl]carbamate
CID 69217510
methyl N-[2-(5-fluoro-1H-indol-3-yl)ethyl]carbamate
CID 110731487
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-(pyridin-3-ylcarbamoylamino)benzamide
CID 154724354
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]pyridine-3-carboxamide
CID 110731484
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-(phenylsulfanylmethyl)furan-3-carboxamide
CID 4897660

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide?
The IUPAC name of N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide (CID 155516405) is N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide.
What is the SMILES notation for N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide?
The canonical SMILES for N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide is O=C(NCCc1c[nH]c2ccc(F)cc12)c1ccccc1O.
What is the InChIKey of N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide?
The InChIKey is SXZIDDGDFXJKEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O2/c18-12-5-6-15-14(9-12)11(10-20-15)7-8-19-17(22)13-3-1-2-4-16(13)21/h1-6,9-10,20-21H,7-8H2,(H,19,22).
What are the key properties of N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide?
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide has a molecular weight of 298.32 g/mol, XLogP of 2.99, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxybenzamide is sourced from PubChem (CID 155516405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).