2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine

C12H14N4O2 — CID 80653257

IUPAC2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine
SMILESCOc1ccc(OC)c(Nc2cnc(N)cn2)c1
InChIInChI=1S/C12H14N4O2/c1-17-8-3-4-10(18-2)9(5-8)16-12-7-14-11(13)6-15-12/h3-7H,1-2H3,(H2,13,14)(H,15,16)
InChIKeyICDKDMSFIYEZTG-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.82
Rot. Bonds4

About 2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine

2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine (PubChem CID 80653257) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is 2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine.

Molecular Properties

Compound Name2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine
PubChem CID80653257
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC Name2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine
SMILESCOc1ccc(OC)c(Nc2cnc(N)cn2)c1
InChIInChI=1S/C12H14N4O2/c1-17-8-3-4-10(18-2)9(5-8)16-12-7-14-11(13)6-15-12/h3-7H,1-2H3,(H2,13,14)(H,15,16)
InChIKeyICDKDMSFIYEZTG-UHFFFAOYSA-N
XLogP1.82
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,5-dimethoxyphenyl)pyrimidin-4-amine
CID 152662763
N-(2,5-dimethoxyphenyl)-4-methylpyridin-2-amine
CID 91756707
N-(2,5-dimethoxyphenyl)-5-nitropyridin-2-amine
CID 3750418
2-N-(6-methoxy-1,3-benzothiazol-2-yl)pyrazine-2,5-diamine
CID 80653006
5-(2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)pyrazine-2-carboxamide
CID 109291247
4-N-(2,5-dimethoxyphenyl)-6-N-(3,4-dimethoxyphenyl)pyrimidine-4,6-diamine
CID 112866453
5-(2,5-dimethoxyanilino)-N-(2,4-dimethylphenyl)pyrazine-2-carboxamide
CID 109290731
ethyl N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]carbamate
CID 113019994
N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide
CID 113034610
N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-ethylbutanamide
CID 113019957
N-(3-chloro-2-methylphenyl)-5-(2,5-dimethoxyanilino)pyrazine-2-carboxamide
CID 109292936
N-[(4-chlorophenyl)methyl]-5-(2,5-dimethoxyanilino)pyrazine-2-carboxamide
CID 109282055

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine?
The IUPAC name of 2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine (CID 80653257) is 2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine.
What is the SMILES notation for 2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine?
The canonical SMILES for 2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine is COc1ccc(OC)c(Nc2cnc(N)cn2)c1.
What is the InChIKey of 2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine?
The InChIKey is ICDKDMSFIYEZTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c1-17-8-3-4-10(18-2)9(5-8)16-12-7-14-11(13)6-15-12/h3-7H,1-2H3,(H2,13,14)(H,15,16).
What are the key properties of 2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine?
2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine has a molecular weight of 246.27 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,5-dimethoxyphenyl)pyrazine-2,5-diamine is sourced from PubChem (CID 80653257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).