N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide

C26H27FN8O6 — CID 90811775

IUPACN-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide
SMILESCN(CC(=O)N1CCN(c2ccc(N3CC(CNC(=O)C=O)OC3=O)cc2F)CC1)C(=O)c1cn2ccncc2n1
InChIInChI=1S/C26H27FN8O6/c1-31(25(39)20-14-34-5-4-28-12-22(34)30-20)15-24(38)33-8-6-32(7-9-33)21-3-2-17(10-19(21)27)35-13-18(41-26(35)40)11-29-23(37)16-36/h2-5,10,12,14,16,18H,6-9,11,13,15H2,1H3,(H,29,37)
InChIKeyDNMYNMQTDMZXLR-UHFFFAOYSA-N
MW566.55 g/mol
LogP-0.07
Rot. Bonds8

About N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide

N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide (PubChem CID 90811775) has the molecular formula C26H27FN8O6 and a molecular weight of 566.55 g/mol. Its IUPAC name is N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide
PubChem CID90811775
Molecular FormulaC26H27FN8O6
Molecular Weight566.55 g/mol
Exact Mass566.20
IUPAC NameN-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide
SMILESCN(CC(=O)N1CCN(c2ccc(N3CC(CNC(=O)C=O)OC3=O)cc2F)CC1)C(=O)c1cn2ccncc2n1
InChIInChI=1S/C26H27FN8O6/c1-31(25(39)20-14-34-5-4-28-12-22(34)30-20)15-24(38)33-8-6-32(7-9-33)21-3-2-17(10-19(21)27)35-13-18(41-26(35)40)11-29-23(37)16-36/h2-5,10,12,14,16,18H,6-9,11,13,15H2,1H3,(H,29,37)
InChIKeyDNMYNMQTDMZXLR-UHFFFAOYSA-N
XLogP-0.07
TPSA149.76 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms41
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500566.55
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide 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

methyl N-[[(5S)-3-[4-[4-[2-[ethyl(imidazo[1,2-a]pyrazine-2-carbonyl)amino]acetyl]piperazin-1-yl]-3,5-difluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]carbamate
CID 46213283
N-[2-[4-[2-fluoro-4-[5-(1,2-oxazol-3-yloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]imidazo[1,2-a]pyrazine-2-carboxamide
CID 75150543
N-[[(5S)-3-[3-fluoro-4-[4-(pyrazine-2-carbonyl)piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 58862063
2,2-difluoro-N-[[(5S)-3-[3-fluoro-4-[4-(2-hydroxyacetyl)piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 23658431
2,2,2-trideuterio-N-[[(5S)-3-[3-fluoro-4-[4-(2-hydroxyacetyl)piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 171381822
methyl N-[[3-[3,5-difluoro-4-[4-[2-(imidazo[1,2-a]pyrazine-2-carbonylamino)propanoyl]piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]carbamate
CID 77428567
N-[[(5S)-3-[3-fluoro-4-[4-[(E)-3-pyridin-3-ylprop-2-enoyl]piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]ethanethioamide
CID 10195670
N-[[(5S)-3-[4-[4-[2-(tert-butylamino)acetyl]piperazin-1-yl]-3-fluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 166726440
N-[[3-[3-fluoro-4-[4-(2-hydroxyacetyl)piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]-3-methylbutanethioamide
CID 18619374
2-amino-N-[[(5S)-3-[3-fluoro-4-[4-(2-methoxyacetyl)piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 10251711
N-[[(5S)-3-[3-fluoro-4-[4-(5-methyl-1,2-oxazole-3-carbonyl)piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 58862068
tert-butyl N-[[3-[3-fluoro-4-[4-(2-methylsulfanylacetyl)piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]carbamate
CID 72519228

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide?
The IUPAC name of N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide (CID 90811775) is N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide.
What is the SMILES notation for N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide?
The canonical SMILES for N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide is CN(CC(=O)N1CCN(c2ccc(N3CC(CNC(=O)C=O)OC3=O)cc2F)CC1)C(=O)c1cn2ccncc2n1.
What is the InChIKey of N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide?
The InChIKey is DNMYNMQTDMZXLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27FN8O6/c1-31(25(39)20-14-34-5-4-28-12-22(34)30-20)15-24(38)33-8-6-32(7-9-33)21-3-2-17(10-19(21)27)35-13-18(41-26(35)40)11-29-23(37)16-36/h2-5,10,12,14,16,18H,6-9,11,13,15H2,1H3,(H,29,37).
What are the key properties of N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide?
N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 566.55 g/mol, XLogP of -0.07, 8 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-[2-fluoro-4-[5-[(oxaldehydoylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazin-1-yl]-2-oxoethyl]-N-methylimidazo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 90811775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).