3,6-dimethyl-N-phenylpyrazin-2-amine

C12H13N3 — CID 518389

IUPAC3,6-dimethyl-N-phenylpyrazin-2-amine
SMILESCc1cnc(C)c(Nc2ccccc2)n1
InChIInChI=1S/C12H13N3/c1-9-8-13-10(2)12(14-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,14,15)
InChIKeyPOVOGNYQAMJQOM-UHFFFAOYSA-N
MW199.26 g/mol
LogP2.84
Rot. Bonds2

About 3,6-dimethyl-N-phenylpyrazin-2-amine

3,6-dimethyl-N-phenylpyrazin-2-amine (PubChem CID 518389) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is 3,6-dimethyl-N-phenylpyrazin-2-amine.

Molecular Properties

Compound Name3,6-dimethyl-N-phenylpyrazin-2-amine
PubChem CID518389
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC Name3,6-dimethyl-N-phenylpyrazin-2-amine
SMILESCc1cnc(C)c(Nc2ccccc2)n1
InChIInChI=1S/C12H13N3/c1-9-8-13-10(2)12(14-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,14,15)
InChIKeyPOVOGNYQAMJQOM-UHFFFAOYSA-N
XLogP2.84
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3,6-dimethylpyrazin-2-yl)amino]benzoic acid
CID 65419247
3,6-dimethyl-N-(2-phenylethyl)pyrazin-2-amine
CID 60631499
6-methyl-2-N-phenylpyridine-2,3-diamine
CID 79003921
1-[(3,6-dimethylpyrazin-2-yl)amino]-2-phenylpropan-2-ol
CID 133471206
2-[(3,6-dimethylpyrazin-2-yl)amino]-1-phenylethanol
CID 60634143
3,6-dimethyl-N-[1-(2-methylphenyl)ethyl]pyrazin-2-amine
CID 60703972
5-anilino-6-methyl-2H-1,2,4-triazine-3-thione
CID 23412289
carbanide;ethane;5-methyl-2-N,4-N-diphenylpyrimidine-2,4-diamine;yttrium
CID 157300828
1-N-(3,6-dimethylpyrazin-2-yl)-1-N',1-N'-dimethylethane-1,1-diamine
CID 70592392
3-[3-(6-chloro-3-pyridinyl)propyl]-6-methyl-N-phenylpyridin-2-amine
CID 87549970
(3S)-4-[(3,6-dimethylpyrazin-2-yl)amino]-3-phenylbutan-1-ol
CID 124617179
3,6-dimethyl-N-pentylpyrazin-2-amine
CID 60631563

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-N-phenylpyrazin-2-amine?
The IUPAC name of 3,6-dimethyl-N-phenylpyrazin-2-amine (CID 518389) is 3,6-dimethyl-N-phenylpyrazin-2-amine.
What is the SMILES notation for 3,6-dimethyl-N-phenylpyrazin-2-amine?
The canonical SMILES for 3,6-dimethyl-N-phenylpyrazin-2-amine is Cc1cnc(C)c(Nc2ccccc2)n1.
What is the InChIKey of 3,6-dimethyl-N-phenylpyrazin-2-amine?
The InChIKey is POVOGNYQAMJQOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c1-9-8-13-10(2)12(14-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,14,15).
What are the key properties of 3,6-dimethyl-N-phenylpyrazin-2-amine?
3,6-dimethyl-N-phenylpyrazin-2-amine has a molecular weight of 199.26 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-N-phenylpyrazin-2-amine is sourced from PubChem (CID 518389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).