5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide

C16H23N5O3 — CID 129345384

IUPAC5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide
SMILESCN(C)c1cnc(C(=O)N[C@@H]2CCC(=O)N[C@@H]2[C@@H]2CCCO2)cn1
InChIInChI=1S/C16H23N5O3/c1-21(2)13-9-17-11(8-18-13)16(23)19-10-5-6-14(22)20-15(10)12-4-3-7-24-12/h8-10,12,15H,3-7H2,1-2H3,(H,19,23)(H,20,22)/t10-,12+,15+/m1/s1
InChIKeyOSVZURIPKKEMAX-GMXABZIVSA-N
MW333.39 g/mol
LogP0.10
Rot. Bonds4

About 5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide

5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide (PubChem CID 129345384) has the molecular formula C16H23N5O3 and a molecular weight of 333.39 g/mol. Its IUPAC name is 5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide
PubChem CID129345384
Molecular FormulaC16H23N5O3
Molecular Weight333.39 g/mol
Exact Mass333.18
IUPAC Name5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide
SMILESCN(C)c1cnc(C(=O)N[C@@H]2CCC(=O)N[C@@H]2[C@@H]2CCCO2)cn1
InChIInChI=1S/C16H23N5O3/c1-21(2)13-9-17-11(8-18-13)16(23)19-10-5-6-14(22)20-15(10)12-4-3-7-24-12/h8-10,12,15H,3-7H2,1-2H3,(H,19,23)(H,20,22)/t10-,12+,15+/m1/s1
InChIKeyOSVZURIPKKEMAX-GMXABZIVSA-N
XLogP0.10
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide with MolForge

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Related Compounds

1,1-dimethyl-3-[6-oxo-2-(oxolan-2-yl)piperidin-3-yl]urea
CID 136543336
5-(dimethylamino)-N-[(2S,3S)-2-(1-ethylimidazol-2-yl)oxan-3-yl]pyrazine-2-carboxamide
CID 127967879
4-[[[6-oxo-2-(oxolan-2-yl)piperidin-3-yl]carbamoylamino]methyl]benzoic acid
CID 122014707
2-cyclohexyl-N-[6-oxo-2-(oxolan-2-yl)piperidin-3-yl]azetidine-1-carboxamide
CID 166262807
(5R,6R)-5-[(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]-6-(oxolan-2-yl)piperidin-2-one
CID 138019417
(5R,6R)-5-[(4-methoxy-6-methylpyrimidin-2-yl)amino]-6-(oxolan-2-yl)piperidin-2-one
CID 138019416
N-[1-(tert-butylcarbamoyl)piperidin-4-yl]-5-(dimethylamino)pyrazine-2-carboxamide
CID 154739087
methyl 5-[methyl(oxolan-2-ylmethyl)amino]pyrazine-2-carboxylate
CID 104696750
5-(dimethylamino)-N-(1-methylcyclopropyl)sulfonylpyrazine-2-carboxamide
CID 154763213
2-(dimethylamino)-N-[(2S,3R)-6-oxo-2-phenylpiperidin-3-yl]pyridine-4-carboxamide
CID 146130820
N-[(4aS,6R,8aR)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]dioxin-6-yl]-5-methylpyrazine-2-carboxamide
CID 124876813
N-[(2R,3S)-2-cyclohexyl-6-oxopiperidin-3-yl]-1,3-benzodioxole-5-carboxamide
CID 92571774

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide?
The IUPAC name of 5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide (CID 129345384) is 5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide?
The canonical SMILES for 5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide is CN(C)c1cnc(C(=O)N[C@@H]2CCC(=O)N[C@@H]2[C@@H]2CCCO2)cn1.
What is the InChIKey of 5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide?
The InChIKey is OSVZURIPKKEMAX-GMXABZIVSA-N. The full InChI is InChI=1S/C16H23N5O3/c1-21(2)13-9-17-11(8-18-13)16(23)19-10-5-6-14(22)20-15(10)12-4-3-7-24-12/h8-10,12,15H,3-7H2,1-2H3,(H,19,23)(H,20,22)/t10-,12+,15+/m1/s1.
What are the key properties of 5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide?
5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 0.10, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-N-[(2S,3R)-6-oxo-2-[(2S)-oxolan-2-yl]piperidin-3-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 129345384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).