2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide

C17H20FN3O3 — CID 154744665

IUPAC2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide
SMILESNC(=O)CC1(O)CCCN(C(=O)Cc2c[nH]c3cc(F)ccc23)C1
InChIInChI=1S/C17H20FN3O3/c18-12-2-3-13-11(9-20-14(13)7-12)6-16(23)21-5-1-4-17(24,10-21)8-15(19)22/h2-3,7,9,20,24H,1,4-6,8,10H2,(H2,19,22)
InChIKeyKLZOPVUSTUGCOI-UHFFFAOYSA-N
MW333.36 g/mol
LogP1.08
Rot. Bonds4

About 2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide

2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide (PubChem CID 154744665) has the molecular formula C17H20FN3O3 and a molecular weight of 333.36 g/mol. Its IUPAC name is 2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide.

Molecular Properties

Compound Name2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide
PubChem CID154744665
Molecular FormulaC17H20FN3O3
Molecular Weight333.36 g/mol
Exact Mass333.15
IUPAC Name2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide
SMILESNC(=O)CC1(O)CCCN(C(=O)Cc2c[nH]c3cc(F)ccc23)C1
InChIInChI=1S/C17H20FN3O3/c18-12-2-3-13-11(9-20-14(13)7-12)6-16(23)21-5-1-4-17(24,10-21)8-15(19)22/h2-3,7,9,20,24H,1,4-6,8,10H2,(H2,19,22)
InChIKeyKLZOPVUSTUGCOI-UHFFFAOYSA-N
XLogP1.08
TPSA99.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.36
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(azepan-1-yl)-2-(6-fluoro-1H-indol-3-yl)ethanone
CID 110856306
1-[3-[(4-fluorophenoxy)methyl]-3-hydroxypiperidin-1-yl]-2-(1H-indol-3-yl)ethanone
CID 155991075
2-(6-fluoro-1H-indol-3-yl)-1-(4-methylsulfinylpiperazin-1-yl)ethanone
CID 123386544
2-(6-fluoro-1H-indol-3-yl)-1-[4-(oxolane-2-carbonyl)piperazin-1-yl]ethanone
CID 172548059
1-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]-2-(6-fluoro-1H-indol-3-yl)ethanone
CID 86878648
N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111464495
1-[(3S,4S)-3-(dimethylamino)-4-ethylpyrrolidin-1-yl]-2-(6-fluoro-1H-indol-3-yl)ethanone
CID 97096930
1-[2-(5-fluoro-2-methoxyphenyl)acetyl]-3-hydroxypiperidine-3-carboxamide
CID 128988914
(2R,3R)-1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-2-methylpiperidine-3-carboxylic acid
CID 122116474
2-(6-fluoro-1H-indol-3-yl)-1-[1-[(3S)-3-(hydroxymethyl)pyrrolidine-1-carbonyl]-3-azabicyclo[3.1.0]hexan-3-yl]ethanone
CID 172898817
2-(5-fluoro-1H-indol-3-yl)-1-(4-hydroxypiperidin-1-yl)ethanone
CID 111425118
2-(5-fluoro-1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)ethanone
CID 110700238

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide?
The IUPAC name of 2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide (CID 154744665) is 2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide.
What is the SMILES notation for 2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide?
The canonical SMILES for 2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide is NC(=O)CC1(O)CCCN(C(=O)Cc2c[nH]c3cc(F)ccc23)C1.
What is the InChIKey of 2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide?
The InChIKey is KLZOPVUSTUGCOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FN3O3/c18-12-2-3-13-11(9-20-14(13)7-12)6-16(23)21-5-1-4-17(24,10-21)8-15(19)22/h2-3,7,9,20,24H,1,4-6,8,10H2,(H2,19,22).
What are the key properties of 2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide?
2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide has a molecular weight of 333.36 g/mol, XLogP of 1.08, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(6-fluoro-1H-indol-3-yl)acetyl]-3-hydroxypiperidin-3-yl]acetamide is sourced from PubChem (CID 154744665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).