N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine

C16H21N3O2 — CID 133469077

IUPACN-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine
SMILESCOc1ccc(OC)c(CN(C)c2nc(C)cnc2C)c1
InChIInChI=1S/C16H21N3O2/c1-11-9-17-12(2)16(18-11)19(3)10-13-8-14(20-4)6-7-15(13)21-5/h6-9H,10H2,1-5H3
InChIKeyGJKIWIVJBPJQKB-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.75
Rot. Bonds5

About N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine

N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine (PubChem CID 133469077) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine.

Molecular Properties

Compound NameN-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine
PubChem CID133469077
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC NameN-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine
SMILESCOc1ccc(OC)c(CN(C)c2nc(C)cnc2C)c1
InChIInChI=1S/C16H21N3O2/c1-11-9-17-12(2)16(18-11)19(3)10-13-8-14(20-4)6-7-15(13)21-5/h6-9H,10H2,1-5H3
InChIKeyGJKIWIVJBPJQKB-UHFFFAOYSA-N
XLogP2.75
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(2,5-dimethoxyphenyl)methyl-methylamino]-5,6-dimethylpyridazine-4-carbonitrile
CID 133275077
2-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-N-methylpyrimidin-4-amine
CID 133304164
N-[[4-(aminomethyl)phenyl]methyl]-N,3,6-trimethylpyrazin-2-amine
CID 54939164
N-[(2,5-dimethoxyphenyl)methyl]-N-methylcarbamoyl chloride
CID 115194742
N'-(3,6-dimethylpyrazin-2-yl)-N'-(4-methoxyphenyl)propane-1,3-diamine
CID 60870620
N-[(2,5-dimethoxyphenyl)methyl]-N-(2,6-dimethyl-3-pyridinyl)acetamide
CID 143936412
2-N-[(5-bromo-2-methoxyphenyl)methyl]-2-N,3-dimethylpyridine-2,5-diamine
CID 115147985
1-N-(3,6-dimethylpyrazin-2-yl)-3-methoxy-1-N-methylpropane-1,2-diamine
CID 63761007
4-chloro-5-[(2,5-dimethoxyphenyl)methyl-methylamino]dithiol-3-one
CID 146381721
4-methoxy-2-[(4-methoxy-N-methylanilino)methyl]phenol
CID 82978580
N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]pyrazine-2-carboxamide
CID 33078253
5-[(2,5-dimethoxyphenyl)methyl-methylamino]pentan-2-one
CID 115236571

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine?
The IUPAC name of N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine (CID 133469077) is N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine.
What is the SMILES notation for N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine?
The canonical SMILES for N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine is COc1ccc(OC)c(CN(C)c2nc(C)cnc2C)c1.
What is the InChIKey of N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine?
The InChIKey is GJKIWIVJBPJQKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-11-9-17-12(2)16(18-11)19(3)10-13-8-14(20-4)6-7-15(13)21-5/h6-9H,10H2,1-5H3.
What are the key properties of N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine?
N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine has a molecular weight of 287.36 g/mol, XLogP of 2.75, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethoxyphenyl)methyl]-N,3,6-trimethylpyrazin-2-amine is sourced from PubChem (CID 133469077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).