3-(2-ethylphenyl)-N-propylpyrazin-2-amine

C15H19N3 — CID 112559353

IUPAC3-(2-ethylphenyl)-N-propylpyrazin-2-amine
SMILESCCCNc1nccnc1-c1ccccc1CC
InChIInChI=1S/C15H19N3/c1-3-9-17-15-14(16-10-11-18-15)13-8-6-5-7-12(13)4-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,18)
InChIKeyIRSAYIRPIDEGII-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.53
Rot. Bonds5

About 3-(2-ethylphenyl)-N-propylpyrazin-2-amine

3-(2-ethylphenyl)-N-propylpyrazin-2-amine (PubChem CID 112559353) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 3-(2-ethylphenyl)-N-propylpyrazin-2-amine.

Molecular Properties

Compound Name3-(2-ethylphenyl)-N-propylpyrazin-2-amine
PubChem CID112559353
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name3-(2-ethylphenyl)-N-propylpyrazin-2-amine
SMILESCCCNc1nccnc1-c1ccccc1CC
InChIInChI=1S/C15H19N3/c1-3-9-17-15-14(16-10-11-18-15)13-8-6-5-7-12(13)4-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,18)
InChIKeyIRSAYIRPIDEGII-UHFFFAOYSA-N
XLogP3.53
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-(2-ethylphenyl)pyrazin-2-amine
CID 112559277
3-(2-ethylphenyl)-N-methylpyrazin-2-amine
CID 112559190
3-(2-propoxyphenyl)-N-propylpyrazin-2-amine
CID 104663160
3-(2,3-difluoro-4-methylphenyl)-N-propylpyrazin-2-amine
CID 107514569
2-(2-ethylphenyl)-3-phenylpyridine
CID 175810753
3-(3-tert-butyl-1-methylpyrazol-4-yl)-N-propylpyrazin-2-amine
CID 115914364
3,4-dimethyl-N-propylpyridin-2-amine
CID 123894121
N-propyl-3-(pyrrolidin-1-ylmethyl)pyridin-2-amine
CID 62470751
N-methyl-2-[[2-(propylamino)-3-pyridinyl]methylsulfanyl]acetamide
CID 114231922
3-[(2-methylphenyl)sulfanylmethyl]-N-propylpyridin-2-amine
CID 62468389
1-[4-[[2-(propylamino)-3-pyridinyl]methyl]piperazin-1-yl]ethanone
CID 62470561
1-[[2-(propylamino)-3-pyridinyl]methyl]pyridin-4-one
CID 62880693

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylphenyl)-N-propylpyrazin-2-amine?
The IUPAC name of 3-(2-ethylphenyl)-N-propylpyrazin-2-amine (CID 112559353) is 3-(2-ethylphenyl)-N-propylpyrazin-2-amine.
What is the SMILES notation for 3-(2-ethylphenyl)-N-propylpyrazin-2-amine?
The canonical SMILES for 3-(2-ethylphenyl)-N-propylpyrazin-2-amine is CCCNc1nccnc1-c1ccccc1CC.
What is the InChIKey of 3-(2-ethylphenyl)-N-propylpyrazin-2-amine?
The InChIKey is IRSAYIRPIDEGII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-3-9-17-15-14(16-10-11-18-15)13-8-6-5-7-12(13)4-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,18).
What are the key properties of 3-(2-ethylphenyl)-N-propylpyrazin-2-amine?
3-(2-ethylphenyl)-N-propylpyrazin-2-amine has a molecular weight of 241.34 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylphenyl)-N-propylpyrazin-2-amine is sourced from PubChem (CID 112559353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).