2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine

C14H18N4O — CID 78988831

IUPAC2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine
SMILESCCOCc1ccccc1CNc1cncc(N)n1
InChIInChI=1S/C14H18N4O/c1-2-19-10-12-6-4-3-5-11(12)7-17-14-9-16-8-13(15)18-14/h3-6,8-9H,2,7,10H2,1H3,(H3,15,17,18)
InChIKeyCXHPGZQIFFTAJL-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.21
Rot. Bonds6

About 2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine

2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine (PubChem CID 78988831) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine
PubChem CID78988831
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine
SMILESCCOCc1ccccc1CNc1cncc(N)n1
InChIInChI=1S/C14H18N4O/c1-2-19-10-12-6-4-3-5-11(12)7-17-14-9-16-8-13(15)18-14/h3-6,8-9H,2,7,10H2,1H3,(H3,15,17,18)
InChIKeyCXHPGZQIFFTAJL-UHFFFAOYSA-N
XLogP2.21
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-[(2-bromophenyl)methyl]pyrazine-2,6-diamine
CID 78988997
N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine
CID 106549558
2-N-benzylpyrazine-2,6-diamine
CID 70838336
2-N-[(2-ethylphenyl)methyl]-6-N-propylpyrazine-2,6-diamine
CID 80845005
2-N-ethylpyrazine-2,6-diamine
CID 69290778
4-N-[[2-(ethoxymethyl)phenyl]methyl]pyrido[2,3-d]pyrimidine-4,7-diamine
CID 133396106
4-ethoxy-5-N-[[2-(ethoxymethyl)phenyl]methyl]-1,2-thiazole-3,5-diamine
CID 103364258
2-amino-N-[[2-(ethoxymethyl)phenyl]methyl]-2-methylpropanamide
CID 61266399
N-[[2-(ethoxymethyl)phenyl]methyl]-5-methyl-1,3,4-thiadiazol-2-amine
CID 64915379
3-bromo-N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridin-2-amine
CID 105366749
2-N-[(5-methylthiophen-2-yl)methyl]pyrazine-2,6-diamine
CID 78988898
4-[[2-(ethoxymethyl)phenyl]methylamino]-N'-hydroxy-2,2-dimethylbutanimidamide
CID 77062012

Frequently Asked Questions

What is the IUPAC name of 2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine?
The IUPAC name of 2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine (CID 78988831) is 2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine.
What is the SMILES notation for 2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine?
The canonical SMILES for 2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine is CCOCc1ccccc1CNc1cncc(N)n1.
What is the InChIKey of 2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine?
The InChIKey is CXHPGZQIFFTAJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-2-19-10-12-6-4-3-5-11(12)7-17-14-9-16-8-13(15)18-14/h3-6,8-9H,2,7,10H2,1H3,(H3,15,17,18).
What are the key properties of 2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine?
2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine has a molecular weight of 258.32 g/mol, XLogP of 2.21, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine is sourced from PubChem (CID 78988831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).