2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide

C17H18F2N4O2 — CID 129475393

IUPAC2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide
SMILESCn1ccnc(N2CCC[C@@H](NC(=O)c3cccc(F)c3F)C2)c1=O
InChIInChI=1S/C17H18F2N4O2/c1-22-9-7-20-15(17(22)25)23-8-3-4-11(10-23)21-16(24)12-5-2-6-13(18)14(12)19/h2,5-7,9,11H,3-4,8,10H2,1H3,(H,21,24)/t11-/m1/s1
InChIKeyJWCLSNJSBSFKGY-LLVKDONJSA-N
MW348.35 g/mol
LogP1.46
Rot. Bonds3

About 2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide

2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide (PubChem CID 129475393) has the molecular formula C17H18F2N4O2 and a molecular weight of 348.35 g/mol. Its IUPAC name is 2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide.

Molecular Properties

Compound Name2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide
PubChem CID129475393
Molecular FormulaC17H18F2N4O2
Molecular Weight348.35 g/mol
Exact Mass348.14
IUPAC Name2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide
SMILESCn1ccnc(N2CCC[C@@H](NC(=O)c3cccc(F)c3F)C2)c1=O
InChIInChI=1S/C17H18F2N4O2/c1-22-9-7-20-15(17(22)25)23-8-3-4-11(10-23)21-16(24)12-5-2-6-13(18)14(12)19/h2,5-7,9,11H,3-4,8,10H2,1H3,(H,21,24)/t11-/m1/s1
InChIKeyJWCLSNJSBSFKGY-LLVKDONJSA-N
XLogP1.46
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.35
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3S)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-2,3-dihydro-1H-indene-4-carboxamide
CID 129336990
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-5-carboxamide
CID 128989356
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-2,3-dihydro-1H-indene-5-carboxamide
CID 154737044
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 128989377
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1,3-thiazole-4-carboxamide
CID 128967028
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-1H-indazole-3-carboxamide
CID 167983413
1-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-3-pyridin-4-ylurea
CID 128965407
tert-butyl N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]carbamate
CID 99817733
3-[3-[4-(2-fluorophenyl)butan-2-ylamino]piperidin-1-yl]-1-methylpyrazin-2-one
CID 128974893
3-[(3S)-3-(2,3-dihydro-1H-inden-2-ylamino)piperidin-1-yl]-1-methylpyrazin-2-one
CID 129475497
N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 128968690
1-methyl-3-[3-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]pyrazin-2-one
CID 136542354

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide?
The IUPAC name of 2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide (CID 129475393) is 2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide.
What is the SMILES notation for 2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide?
The canonical SMILES for 2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide is Cn1ccnc(N2CCC[C@@H](NC(=O)c3cccc(F)c3F)C2)c1=O.
What is the InChIKey of 2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide?
The InChIKey is JWCLSNJSBSFKGY-LLVKDONJSA-N. The full InChI is InChI=1S/C17H18F2N4O2/c1-22-9-7-20-15(17(22)25)23-8-3-4-11(10-23)21-16(24)12-5-2-6-13(18)14(12)19/h2,5-7,9,11H,3-4,8,10H2,1H3,(H,21,24)/t11-/m1/s1.
What are the key properties of 2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide?
2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide has a molecular weight of 348.35 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-N-[(3R)-1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]benzamide is sourced from PubChem (CID 129475393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).