N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide

C18H21FN4O2 — CID 163357192

IUPACN-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCCC(COc2cnccn2)C1)Nc1ccccc1F
InChIInChI=1S/C18H21FN4O2/c19-15-5-1-2-6-16(15)22-17(24)12-23-9-3-4-14(11-23)13-25-18-10-20-7-8-21-18/h1-2,5-8,10,14H,3-4,9,11-13H2,(H,22,24)
InChIKeyRFDQXKWJDCZZPB-UHFFFAOYSA-N
MW344.39 g/mol
LogP2.35
Rot. Bonds6

About N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide

N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide (PubChem CID 163357192) has the molecular formula C18H21FN4O2 and a molecular weight of 344.39 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide
PubChem CID163357192
Molecular FormulaC18H21FN4O2
Molecular Weight344.39 g/mol
Exact Mass344.16
IUPAC NameN-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCCC(COc2cnccn2)C1)Nc1ccccc1F
InChIInChI=1S/C18H21FN4O2/c19-15-5-1-2-6-16(15)22-17(24)12-23-9-3-4-14(11-23)13-25-18-10-20-7-8-21-18/h1-2,5-8,10,14H,3-4,9,11-13H2,(H,22,24)
InChIKeyRFDQXKWJDCZZPB-UHFFFAOYSA-N
XLogP2.35
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 163357417
N-(2-fluorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919928
2-[(3R)-3-[(2-fluorophenoxy)methyl]piperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 92612861
N-(3,4-difluorophenyl)-2-[3-(phenoxymethyl)piperidin-1-yl]acetamide
CID 86972309
N-(4-fluorophenyl)-2-[3-(phenoxymethyl)piperidin-1-yl]acetamide
CID 86972270
(3S)-1-[2-(2-fluoroanilino)-2-oxoethyl]piperidine-3-carboxamide
CID 9305796
N-(2,3-dimethylphenyl)-2-[3-(phenoxymethyl)piperidin-1-yl]acetamide
CID 86972219
2-[[1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methoxy]pyrazine
CID 163354536
N-(2-fluorophenyl)-2-[3-(2-hydroxyethyl)pyrrolidin-1-yl]acetamide
CID 115648320
2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-fluorophenyl)acetamide;hydrochloride
CID 119905386
2-(3-aminopyrrolidin-1-yl)-N-(2-fluorophenyl)acetamide;hydrochloride
CID 119917633
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-(2-fluorophenyl)acetamide
CID 22194026

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide (CID 163357192) is N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide is O=C(CN1CCCC(COc2cnccn2)C1)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide?
The InChIKey is RFDQXKWJDCZZPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN4O2/c19-15-5-1-2-6-16(15)22-17(24)12-23-9-3-4-14(11-23)13-25-18-10-20-7-8-21-18/h1-2,5-8,10,14H,3-4,9,11-13H2,(H,22,24).
What are the key properties of N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide?
N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide has a molecular weight of 344.39 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-[3-(pyrazin-2-yloxymethyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 163357192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).