5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline

C15H20N4O — CID 62761096

IUPAC5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline
SMILESCOc1ccc(CN(C)C)cc1NCc1cnccn1
InChIInChI=1S/C15H20N4O/c1-19(2)11-12-4-5-15(20-3)14(8-12)18-10-13-9-16-6-7-17-13/h4-9,18H,10-11H2,1-3H3
InChIKeyIUHUHVGWDKIOSQ-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.16
Rot. Bonds6

About 5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline

5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline (PubChem CID 62761096) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline.

Molecular Properties

Compound Name5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline
PubChem CID62761096
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline
SMILESCOc1ccc(CN(C)C)cc1NCc1cnccn1
InChIInChI=1S/C15H20N4O/c1-19(2)11-12-4-5-15(20-3)14(8-12)18-10-13-9-16-6-7-17-13/h4-9,18H,10-11H2,1-3H3
InChIKeyIUHUHVGWDKIOSQ-UHFFFAOYSA-N
XLogP2.16
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(dimethylamino)methyl]-2-methoxy-N-(pyridin-3-ylmethyl)aniline
CID 43686524
6-[[5-[(dimethylamino)methyl]-2-methoxyanilino]methyl]pyridin-3-ol
CID 79782269
5-[(dimethylamino)methyl]-N-(2,2-dimethylpropyl)-2-methoxyaniline
CID 61324530
5-[(dimethylamino)methyl]-N-[(5-ethylfuran-2-yl)methyl]-2-methoxyaniline
CID 62346152
5-[(dimethylamino)methyl]-2-methoxy-N-[(2-methylphenyl)methyl]aniline
CID 43686508
5-[(dimethylamino)methyl]-2-methoxy-N-[(3-methylphenyl)methyl]aniline
CID 43686510
2-ethoxy-5-methyl-N-(pyrazin-2-ylmethyl)aniline
CID 83961694
2-[[5-[(dimethylamino)methyl]-2-methoxyanilino]methyl]thiophen-3-amine
CID 66387140
N-[(5-bromofuran-2-yl)methyl]-5-[(dimethylamino)methyl]-2-methoxyaniline
CID 43686533
5-[(dimethylamino)methyl]-N-[(1-ethylpyrrol-2-yl)methyl]-2-methoxyaniline
CID 66410939
5-[(dimethylamino)methyl]-2-methoxy-N-propan-2-ylaniline
CID 43686566
2-chloro-5-methoxy-N-(pyrazin-2-ylmethyl)aniline
CID 62762564

Frequently Asked Questions

What is the IUPAC name of 5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline?
The IUPAC name of 5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline (CID 62761096) is 5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline.
What is the SMILES notation for 5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline?
The canonical SMILES for 5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline is COc1ccc(CN(C)C)cc1NCc1cnccn1.
What is the InChIKey of 5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline?
The InChIKey is IUHUHVGWDKIOSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-19(2)11-12-4-5-15(20-3)14(8-12)18-10-13-9-16-6-7-17-13/h4-9,18H,10-11H2,1-3H3.
What are the key properties of 5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline?
5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline has a molecular weight of 272.35 g/mol, XLogP of 2.16, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(dimethylamino)methyl]-2-methoxy-N-(pyrazin-2-ylmethyl)aniline is sourced from PubChem (CID 62761096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).