N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine

C15H19N3O — CID 133468436

IUPACN-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine
SMILESCCOc1ccccc1CNc1nc(C)cnc1C
InChIInChI=1S/C15H19N3O/c1-4-19-14-8-6-5-7-13(14)10-17-15-12(3)16-9-11(2)18-15/h5-9H,4,10H2,1-3H3,(H,17,18)
InChIKeyPYWNUQCQYFXMOI-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.10
Rot. Bonds5

About N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine

N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine (PubChem CID 133468436) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine.

Molecular Properties

Compound NameN-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine
PubChem CID133468436
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine
SMILESCCOc1ccccc1CNc1nc(C)cnc1C
InChIInChI=1S/C15H19N3O/c1-4-19-14-8-6-5-7-13(14)10-17-15-12(3)16-9-11(2)18-15/h5-9H,4,10H2,1-3H3,(H,17,18)
InChIKeyPYWNUQCQYFXMOI-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

2-[[(3,6-dimethylpyrazin-2-yl)amino]methyl]-6-methoxyphenol
CID 133469932
N-[(3-ethoxy-4-methoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine
CID 133471195
N-[(2-ethoxyphenyl)methyl]-2-methylquinazolin-4-amine
CID 68649031
3,6-dimethyl-N-(quinolin-8-ylmethyl)pyrazin-2-amine
CID 81423227
N-[2-(2-aminophenoxy)ethyl]-3,6-dimethylpyrazin-2-amine
CID 54915740
N-[(2-ethoxyphenyl)methyl]quinolin-3-amine
CID 43691162
N-[(2-ethoxyphenyl)methyl]-1-methylpyrazol-4-amine
CID 43535024
N-[(2-ethoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-amine
CID 43547421
N-[(2-ethoxyphenyl)methyl]-2,6-difluoroaniline
CID 28879073
N-[(2-ethoxyphenyl)methyl]-2-methyl-3H-benzimidazol-5-amine
CID 43746372
N-[(2-ethoxyphenyl)methyl]imidazo[1,5-a]pyrazin-8-amine
CID 53172241
N-[(2-ethoxyphenyl)methyl]-2-methyl-1,3-benzothiazol-6-amine
CID 43231044

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine?
The IUPAC name of N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine (CID 133468436) is N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine.
What is the SMILES notation for N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine?
The canonical SMILES for N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine is CCOc1ccccc1CNc1nc(C)cnc1C.
What is the InChIKey of N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine?
The InChIKey is PYWNUQCQYFXMOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-4-19-14-8-6-5-7-13(14)10-17-15-12(3)16-9-11(2)18-15/h5-9H,4,10H2,1-3H3,(H,17,18).
What are the key properties of N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine?
N-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-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-[(2-ethoxyphenyl)methyl]-3,6-dimethylpyrazin-2-amine is sourced from PubChem (CID 133468436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).