4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline

C20H22N4 — CID 102012408

IUPAC4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline
SMILESCN(C)c1ccc(-c2cnc(-c3ccc(N(C)C)cc3)cn2)cc1
InChIInChI=1S/C20H22N4/c1-23(2)17-9-5-15(6-10-17)19-13-22-20(14-21-19)16-7-11-18(12-8-16)24(3)4/h5-14H,1-4H3
InChIKeyMNZIIUSWUPUWOX-UHFFFAOYSA-N
MW318.42 g/mol
LogP3.94
Rot. Bonds4

About 4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline

4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline (PubChem CID 102012408) has the molecular formula C20H22N4 and a molecular weight of 318.42 g/mol. Its IUPAC name is 4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline
PubChem CID102012408
Molecular FormulaC20H22N4
Molecular Weight318.42 g/mol
Exact Mass318.18
IUPAC Name4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline
SMILESCN(C)c1ccc(-c2cnc(-c3ccc(N(C)C)cc3)cn2)cc1
InChIInChI=1S/C20H22N4/c1-23(2)17-9-5-15(6-10-17)19-13-22-20(14-21-19)16-7-11-18(12-8-16)24(3)4/h5-14H,1-4H3
InChIKeyMNZIIUSWUPUWOX-UHFFFAOYSA-N
XLogP3.94
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(dimethylamino)phenyl]-N,N-dimethylpyridin-4-amine
CID 54101917
N-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]benzamide
CID 102042106
4-[5-(2-aminoethyl)-2-pyridinyl]-N,N-dimethylaniline
CID 59419619
4-[4-(dimethylamino)phenyl]-N,N-dimethylaniline;ethane
CID 91522137
4-([1]benzothiolo[2,3-c]pyridin-3-yl)-N,N-dimethylaniline
CID 122382956
N,N-dimethyl-4-(oxadiazol-4-yl)aniline
CID 172692662
4-[2,6-bis(4-methylphenyl)-4-pyridinyl]-N,N-dimethylaniline
CID 129140985
4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine
CID 18526481
4-(6-tert-butyl-3-pyridinyl)-N,N-dimethylaniline
CID 20709653
4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline
CID 14093519
4-(4-chlorophenyl)-N,N-dimethylaniline
CID 2757476
4-[4-(dimethylamino)phenyl]-N,N-dimethylaniline;methylsulfinylmethane
CID 157316165

Frequently Asked Questions

What is the IUPAC name of 4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline?
The IUPAC name of 4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline (CID 102012408) is 4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline?
The canonical SMILES for 4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline is CN(C)c1ccc(-c2cnc(-c3ccc(N(C)C)cc3)cn2)cc1.
What is the InChIKey of 4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline?
The InChIKey is MNZIIUSWUPUWOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4/c1-23(2)17-9-5-15(6-10-17)19-13-22-20(14-21-19)16-7-11-18(12-8-16)24(3)4/h5-14H,1-4H3.
What are the key properties of 4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline?
4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline has a molecular weight of 318.42 g/mol, XLogP of 3.94, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline is sourced from PubChem (CID 102012408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).