3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide

C16H15N5O2 — CID 136577955

IUPAC3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide
SMILESCc1nc(-c2ccc(NC(=O)c3nccnc3N)cc2)oc1C
InChIInChI=1S/C16H15N5O2/c1-9-10(2)23-16(20-9)11-3-5-12(6-4-11)21-15(22)13-14(17)19-8-7-18-13/h3-8H,1-2H3,(H2,17,19)(H,21,22)
InChIKeyFIMMKISUZSDEDM-UHFFFAOYSA-N
MW309.33 g/mol
LogP2.58
Rot. Bonds3

About 3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide

3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide (PubChem CID 136577955) has the molecular formula C16H15N5O2 and a molecular weight of 309.33 g/mol. Its IUPAC name is 3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide
PubChem CID136577955
Molecular FormulaC16H15N5O2
Molecular Weight309.33 g/mol
Exact Mass309.12
IUPAC Name3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide
SMILESCc1nc(-c2ccc(NC(=O)c3nccnc3N)cc2)oc1C
InChIInChI=1S/C16H15N5O2/c1-9-10(2)23-16(20-9)11-3-5-12(6-4-11)21-15(22)13-14(17)19-8-7-18-13/h3-8H,1-2H3,(H2,17,19)(H,21,22)
InChIKeyFIMMKISUZSDEDM-UHFFFAOYSA-N
XLogP2.58
TPSA106.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyridine-4-carboxamide
CID 5022157
N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 51093188
3-amino-N-(4-iodophenyl)pyrazine-2-carboxamide
CID 46525550
3-amino-N-[4-(1,2,4-oxadiazol-3-yl)phenyl]pyrazine-2-carboxamide
CID 167744736
3-amino-N-(2-methyl-1,3-benzoxazol-6-yl)pyrazine-2-carboxamide
CID 86921862
N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]quinoline-5-carboxamide
CID 167894893
3-amino-N-[3-(5-methyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide
CID 136524529
3-amino-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide
CID 38404382
N-(4-fluorophenyl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
CID 17393566
3-amino-N-[3-(4,5-dimethyl-1H-imidazol-2-yl)phenyl]pyrazine-2-carboxamide
CID 75369727
(E)-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]-3-pyridin-3-ylprop-2-enamide
CID 51092375
3-amino-N-[4-(2-amino-2-oxoethoxy)phenyl]pyrazine-2-carboxamide
CID 30831083

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide?
The IUPAC name of 3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide (CID 136577955) is 3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide?
The canonical SMILES for 3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide is Cc1nc(-c2ccc(NC(=O)c3nccnc3N)cc2)oc1C.
What is the InChIKey of 3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide?
The InChIKey is FIMMKISUZSDEDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O2/c1-9-10(2)23-16(20-9)11-3-5-12(6-4-11)21-15(22)13-14(17)19-8-7-18-13/h3-8H,1-2H3,(H2,17,19)(H,21,22).
What are the key properties of 3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide?
3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide has a molecular weight of 309.33 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide is sourced from PubChem (CID 136577955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).