2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline

C15H19N3 — CID 102613140

IUPAC2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline
SMILESCc1cccc(NC(C)c2nccnc2C)c1C
InChIInChI=1S/C15H19N3/c1-10-6-5-7-14(11(10)2)18-13(4)15-12(3)16-8-9-17-15/h5-9,13,18H,1-4H3
InChIKeyBXBSZVSMFXLAIJ-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.57
Rot. Bonds3

About 2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline

2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline (PubChem CID 102613140) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline.

Molecular Properties

Compound Name2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline
PubChem CID102613140
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline
SMILESCc1cccc(NC(C)c2nccnc2C)c1C
InChIInChI=1S/C15H19N3/c1-10-6-5-7-14(11(10)2)18-13(4)15-12(3)16-8-9-17-15/h5-9,13,18H,1-4H3
InChIKeyBXBSZVSMFXLAIJ-UHFFFAOYSA-N
XLogP3.57
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dimethyl-N-(1-pyridin-2-ylethyl)aniline
CID 43196433
N-[1-(3-methylpyrazin-2-yl)ethyl]aniline
CID 102612936
4-fluoro-2-methyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline
CID 102613284
3-methyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline
CID 102613155
2-methyl-N-[1-(2-methylphenyl)ethyl]pyridin-3-amine
CID 79041978
2-methyl-N-[1-(2,4,6-trimethylphenyl)ethyl]pyridin-3-amine
CID 79041619
2-(2,3-dimethylanilino)propan-1-ol
CID 21221760
6-bromo-N-[1-(3-methylpyrazin-2-yl)ethyl]-2,3-dihydro-1,4-benzodioxin-7-amine
CID 102613385
2,3-dimethyl-N-[1-[2-(trifluoromethyl)phenyl]ethyl]aniline
CID 43105751
N-(1-cyclopropylethyl)-2,3-dimethylaniline
CID 43196438
2-(2,3-dimethylanilino)propanoic acid
CID 13138172
3-N-(2,3-dimethylphenyl)butane-1,3-diamine
CID 117027018

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline?
The IUPAC name of 2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline (CID 102613140) is 2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline.
What is the SMILES notation for 2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline?
The canonical SMILES for 2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline is Cc1cccc(NC(C)c2nccnc2C)c1C.
What is the InChIKey of 2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline?
The InChIKey is BXBSZVSMFXLAIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-10-6-5-7-14(11(10)2)18-13(4)15-12(3)16-8-9-17-15/h5-9,13,18H,1-4H3.
What are the key properties of 2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline?
2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline has a molecular weight of 241.34 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[1-(3-methylpyrazin-2-yl)ethyl]aniline is sourced from PubChem (CID 102613140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).