N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine

C15H19N3O — CID 133470930

IUPACN-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine
SMILESCCOc1ccc(CNc2cncc(C)n2)cc1C
InChIInChI=1S/C15H19N3O/c1-4-19-14-6-5-13(7-11(14)2)9-17-15-10-16-8-12(3)18-15/h5-8,10H,4,9H2,1-3H3,(H,17,18)
InChIKeyZLMCRGPXEHSDGZ-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.10
Rot. Bonds5

About N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine

N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine (PubChem CID 133470930) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine.

Molecular Properties

Compound NameN-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine
PubChem CID133470930
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine
SMILESCCOc1ccc(CNc2cncc(C)n2)cc1C
InChIInChI=1S/C15H19N3O/c1-4-19-14-6-5-13(7-11(14)2)9-17-15-10-16-8-12(3)18-15/h5-8,10H,4,9H2,1-3H3,(H,17,18)
InChIKeyZLMCRGPXEHSDGZ-UHFFFAOYSA-N
XLogP3.10
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-ethoxy-3-methylphenyl)methyl]-4-methyl-5-nitropyridin-2-amine
CID 133339278
N-[(3-ethoxy-4-methoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine
CID 133471195
6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine
CID 78990492
N-[(4-bromo-3-methylphenyl)methyl]-6-methoxypyrazin-2-amine
CID 155403354
1-N-[(4-ethoxy-3-methylphenyl)methyl]-3-methylbutane-1,3-diamine
CID 115200606
2-[3-[[(6-methylpyrazin-2-yl)amino]methyl]phenoxy]butanenitrile
CID 133471180
N-methyl-1-[3-[[(6-methylpyrazin-2-yl)amino]methyl]phenyl]methanesulfonamide
CID 75507248
5-bromo-N-[(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine
CID 115146650
N-[(3-aminophenyl)methyl]-4-ethoxy-3-methylaniline
CID 115211777
4-ethoxy-N-ethyl-3-methylaniline
CID 82490653
N-(2-methylpropyl)-4-[[(6-methylpyrazin-2-yl)amino]methyl]benzenesulfonamide
CID 75522952
3-ethoxy-N-[(4-methoxy-3-methylphenyl)methyl]aniline
CID 60935106

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine?
The IUPAC name of N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine (CID 133470930) is N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine.
What is the SMILES notation for N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine?
The canonical SMILES for N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine is CCOc1ccc(CNc2cncc(C)n2)cc1C.
What is the InChIKey of N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine?
The InChIKey is ZLMCRGPXEHSDGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-4-19-14-6-5-13(7-11(14)2)9-17-15-10-16-8-12(3)18-15/h5-8,10H,4,9H2,1-3H3,(H,17,18).
What are the key properties of N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine?
N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine has a molecular weight of 257.34 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine is sourced from PubChem (CID 133470930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).