1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine

C20H19N3 — CID 146266450

IUPAC1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine
SMILESC=C(NCc1cnccn1)c1c(C)cccc1-c1ccccc1
InChIInChI=1S/C20H19N3/c1-15-7-6-10-19(17-8-4-3-5-9-17)20(15)16(2)23-14-18-13-21-11-12-22-18/h3-13,23H,2,14H2,1H3
InChIKeyAOJHHFJFQXMQET-UHFFFAOYSA-N
MW301.39 g/mol
LogP4.21
Rot. Bonds5

About 1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine

1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine (PubChem CID 146266450) has the molecular formula C20H19N3 and a molecular weight of 301.39 g/mol. Its IUPAC name is 1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine.

Molecular Properties

Compound Name1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine
PubChem CID146266450
Molecular FormulaC20H19N3
Molecular Weight301.39 g/mol
Exact Mass301.16
IUPAC Name1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine
SMILESC=C(NCc1cnccn1)c1c(C)cccc1-c1ccccc1
InChIInChI=1S/C20H19N3/c1-15-7-6-10-19(17-8-4-3-5-9-17)20(15)16(2)23-14-18-13-21-11-12-22-18/h3-13,23H,2,14H2,1H3
InChIKeyAOJHHFJFQXMQET-UHFFFAOYSA-N
XLogP4.21
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-Diphenylpyrazine
CID 243907
2,5-Diphenylpyrazine
CID 220958
1-(1-Phenyl-2-(pyridin-2-yl)ethyl)piperazine
CID 44414862
N,N-dimethyl-2-(3-(pyrazin-2-ylmethyl)-1H-inden-2-yl)ethanamine
CID 11265950
4-[5-(4-Carbamimidoylphenyl)pyrazin-2-yl]benzamidine
CID 12207761
3-methyl-N-[[6-[(3-methylanilino)methyl]-3-pyridinyl]methyl]aniline
CID 134132646
N-(2-pyridinylmethyl)-N-{4-[4,7,10-triazabicyclo[11.3.1]heptadeca-1(17),13,15-trien-7-ylmethyl]benzyl}amine
CID 503779
N-ethyl-N-methyl-2-(3-(pyrazin-2-ylmethyl)-1H-inden-2-yl)ethanamine
CID 53320177
N-[(2-phenylphenyl)methyl]-7-(4-pyridin-3-yltriazol-1-yl)heptan-1-amine
CID 86305920
N-[(2-phenylphenyl)methyl]-6-(4-pyridin-3-yltriazol-1-yl)hexan-1-amine
CID 86305921
N-[(2-phenylphenyl)methyl]-8-(4-pyridin-3-yltriazol-1-yl)octan-1-amine
CID 86305974
4-ethyl-N-[[6-[(4-ethylanilino)methyl]-3-pyridinyl]methyl]aniline
CID 145233160

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine?
The IUPAC name of 1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine (CID 146266450) is 1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine.
What is the SMILES notation for 1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine?
The canonical SMILES for 1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine is C=C(NCc1cnccn1)c1c(C)cccc1-c1ccccc1.
What is the InChIKey of 1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine?
The InChIKey is AOJHHFJFQXMQET-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3/c1-15-7-6-10-19(17-8-4-3-5-9-17)20(15)16(2)23-14-18-13-21-11-12-22-18/h3-13,23H,2,14H2,1H3.
What are the key properties of 1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine?
1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine has a molecular weight of 301.39 g/mol, XLogP of 4.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-6-phenylphenyl)-N-(pyrazin-2-ylmethyl)ethenamine is sourced from PubChem (CID 146266450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).