N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline

C14H18N4O — CID 66449849

IUPACN,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline
SMILESCNCc1cncc(Oc2cccc(N(C)C)c2)n1
InChIInChI=1S/C14H18N4O/c1-15-8-11-9-16-10-14(17-11)19-13-6-4-5-12(7-13)18(2)3/h4-7,9-10,15H,8H2,1-3H3
InChIKeyAPYCTIORHVUBMK-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.05
Rot. Bonds5

About N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline

N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline (PubChem CID 66449849) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline.

Molecular Properties

Compound NameN,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline
PubChem CID66449849
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline
SMILESCNCc1cncc(Oc2cccc(N(C)C)c2)n1
InChIInChI=1S/C14H18N4O/c1-15-8-11-9-16-10-14(17-11)19-13-6-4-5-12(7-13)18(2)3/h4-7,9-10,15H,8H2,1-3H3
InChIKeyAPYCTIORHVUBMK-UHFFFAOYSA-N
XLogP2.05
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(6-naphthalen-2-yloxypyrazin-2-yl)methanamine
CID 66450822
N,N-dimethyl-3-[[4-(methylaminomethyl)-1,3-oxazol-2-yl]oxy]aniline
CID 113378039
N,N-dimethyl-3-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]oxy]aniline
CID 62322084
N-methyl-1-(6-naphthalen-1-yloxypyrazin-2-yl)methanamine
CID 66450632
N-[[6-(3-bromophenoxy)pyrazin-2-yl]methyl]propan-2-amine
CID 66450240
1-[6-(2-bromophenoxy)pyrazin-2-yl]-N-methylmethanamine
CID 66450805
N,N-dimethyl-3-[3-methyl-4-(methylaminomethyl)phenoxy]aniline
CID 62128804
N-(3-fluorophenyl)-N-methyl-6-(methylaminomethyl)pyrazin-2-amine
CID 66449078
6-[3-(dimethylamino)phenoxy]-N-propylpyridin-2-amine
CID 80871143
1-[6-(2,5-dibromo-4-methoxyphenoxy)pyrazin-2-yl]-N-methylmethanamine
CID 79404096
3-[[3-(aminomethyl)-4-pyridinyl]oxy]-N,N-dimethylaniline
CID 81251232
3-(6-chloro-2-ethylpyrimidin-4-yl)oxy-N,N-dimethylaniline
CID 80944453

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline?
The IUPAC name of N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline (CID 66449849) is N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline.
What is the SMILES notation for N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline?
The canonical SMILES for N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline is CNCc1cncc(Oc2cccc(N(C)C)c2)n1.
What is the InChIKey of N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline?
The InChIKey is APYCTIORHVUBMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-15-8-11-9-16-10-14(17-11)19-13-6-4-5-12(7-13)18(2)3/h4-7,9-10,15H,8H2,1-3H3.
What are the key properties of N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline?
N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline has a molecular weight of 258.32 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[6-(methylaminomethyl)pyrazin-2-yl]oxyaniline is sourced from PubChem (CID 66449849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).