3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide

C16H16N6O2 — CID 129359034

IUPAC3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide
SMILESCc1noc(C[C@@H](NC(=O)c2nccnc2N)c2ccccc2)n1
InChIInChI=1S/C16H16N6O2/c1-10-20-13(24-22-10)9-12(11-5-3-2-4-6-11)21-16(23)14-15(17)19-8-7-18-14/h2-8,12H,9H2,1H3,(H2,17,19)(H,21,23)/t12-/m1/s1
InChIKeyBSGBQQBVXLUGDR-GFCCVEGCSA-N
MW324.34 g/mol
LogP1.46
Rot. Bonds5

About 3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide

3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide (PubChem CID 129359034) has the molecular formula C16H16N6O2 and a molecular weight of 324.34 g/mol. Its IUPAC name is 3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide
PubChem CID129359034
Molecular FormulaC16H16N6O2
Molecular Weight324.34 g/mol
Exact Mass324.13
IUPAC Name3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide
SMILESCc1noc(C[C@@H](NC(=O)c2nccnc2N)c2ccccc2)n1
InChIInChI=1S/C16H16N6O2/c1-10-20-13(24-22-10)9-12(11-5-3-2-4-6-11)21-16(23)14-15(17)19-8-7-18-14/h2-8,12H,9H2,1H3,(H2,17,19)(H,21,23)/t12-/m1/s1
InChIKeyBSGBQQBVXLUGDR-GFCCVEGCSA-N
XLogP1.46
TPSA119.82 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]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

N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]-2H-benzotriazole-5-carboxamide
CID 129359252
(3-methyl-1,2,4-oxadiazol-5-yl)methyl (2R)-2-benzamido-3-phenylpropanoate
CID 31048252
4-amino-N-[(1R)-2-(dimethylamino)-1-phenylethyl]-1,2,5-oxadiazole-3-carboxamide
CID 92606094
4-amino-N-[(1S)-2-(dimethylamino)-1-phenylethyl]-1,2,5-oxadiazole-3-carboxamide
CID 92606092
3-amino-N-[(2R)-4-phenylbutan-2-yl]pyrazine-2-carboxamide
CID 30138259
N-[(3-bromo-1,2-oxazol-5-yl)methyl]-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethanamine;2,2,2-trifluoroacetic acid
CID 167958821
N-benzhydryl-3-methyl-1,2,4-oxadiazole-5-carboxamide
CID 29131381
3-amino-N-(1-thiophen-2-ylpropyl)pyrazine-2-carboxamide
CID 119132592
4-amino-5-methyl-N-(1-phenylpropyl)-1H-pyrazole-3-carboxamide
CID 62305713
3-amino-N-[2-(diethylamino)-2-phenylethyl]pyrazine-2-carboxamide
CID 43046291
4-(5-fluoro-2,3-dihydroindol-1-yl)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]piperidine-1-carboxamide
CID 154805799
3-amino-N-[3,3,3-trifluoro-1-(4-fluorophenyl)propyl]pyrazine-2-carboxamide
CID 122157931

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide?
The IUPAC name of 3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide (CID 129359034) is 3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide?
The canonical SMILES for 3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide is Cc1noc(C[C@@H](NC(=O)c2nccnc2N)c2ccccc2)n1.
What is the InChIKey of 3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide?
The InChIKey is BSGBQQBVXLUGDR-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H16N6O2/c1-10-20-13(24-22-10)9-12(11-5-3-2-4-6-11)21-16(23)14-15(17)19-8-7-18-14/h2-8,12H,9H2,1H3,(H2,17,19)(H,21,23)/t12-/m1/s1.
What are the key properties of 3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide?
3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide has a molecular weight of 324.34 g/mol, XLogP of 1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(1R)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-phenylethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 129359034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).