3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine

C15H16N6O — CID 68945362

IUPAC3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine
SMILESCOc1cccc(-c2ncc(Nc3cc(C)[nH]n3)nc2N)c1
InChIInChI=1S/C15H16N6O/c1-9-6-12(21-20-9)18-13-8-17-14(15(16)19-13)10-4-3-5-11(7-10)22-2/h3-8H,1-2H3,(H4,16,18,19,20,21)
InChIKeyYFQWSPQEOWRTMA-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.51
Rot. Bonds4

About 3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine

3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine (PubChem CID 68945362) has the molecular formula C15H16N6O and a molecular weight of 296.33 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine
PubChem CID68945362
Molecular FormulaC15H16N6O
Molecular Weight296.33 g/mol
Exact Mass296.14
IUPAC Name3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine
SMILESCOc1cccc(-c2ncc(Nc3cc(C)[nH]n3)nc2N)c1
InChIInChI=1S/C15H16N6O/c1-9-6-12(21-20-9)18-13-8-17-14(15(16)19-13)10-4-3-5-11(7-10)22-2/h3-8H,1-2H3,(H4,16,18,19,20,21)
InChIKeyYFQWSPQEOWRTMA-UHFFFAOYSA-N
XLogP2.51
TPSA101.74 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

3-(5-methyl-1H-pyrazol-3-yl)-6-N-pyridin-2-ylpyrazine-2,6-diamine
CID 68994139
3-(3-fluorophenyl)-6-N-(3,4,5-trimethoxyphenyl)pyrazine-2,6-diamine
CID 66912561
3-(3-methoxyphenyl)-6-methyl-1H-pyrazin-2-one
CID 125458438
2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
CID 132941107
5-(3-methoxyphenyl)-1H-imidazol-4-amine
CID 82468693
4-(3-methoxyphenyl)-3-methyl-2H-pyrazolo[4,3-c]pyridine
CID 59619134
5-N-(2-aminoethyl)-4-(3-methoxyphenyl)pyrimidine-2,5-diamine
CID 117211103
6-(3-methoxyphenyl)-1,2,4-triazin-5-amine
CID 116823084
CID 89206680
CID 89206680
3-amino-5,6-bis(3-methoxyphenyl)-1H-pyrazin-2-one
CID 132588517
5-(5-fluoro-2-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine
CID 104638670
5-[5-(3-methoxyphenyl)-1H-1,2,4-triazol-3-yl]benzene-1,3-diamine
CID 43826589

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine?
The IUPAC name of 3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine (CID 68945362) is 3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine.
What is the SMILES notation for 3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine?
The canonical SMILES for 3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine is COc1cccc(-c2ncc(Nc3cc(C)[nH]n3)nc2N)c1.
What is the InChIKey of 3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine?
The InChIKey is YFQWSPQEOWRTMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O/c1-9-6-12(21-20-9)18-13-8-17-14(15(16)19-13)10-4-3-5-11(7-10)22-2/h3-8H,1-2H3,(H4,16,18,19,20,21).
What are the key properties of 3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine?
3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine has a molecular weight of 296.33 g/mol, XLogP of 2.51, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyphenyl)-6-N-(5-methyl-1H-pyrazol-3-yl)pyrazine-2,6-diamine is sourced from PubChem (CID 68945362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).