2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline

C14H12N4 — CID 141174884

IUPAC2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline
SMILESCc1ccc(-c2cnc3cccnc3n2)cc1N
InChIInChI=1S/C14H12N4/c1-9-4-5-10(7-11(9)15)13-8-17-12-3-2-6-16-14(12)18-13/h2-8H,15H2,1H3
InChIKeyKCLZHILGLLTQFN-UHFFFAOYSA-N
MW236.28 g/mol
LogP2.58
Rot. Bonds1

About 2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline

2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline (PubChem CID 141174884) has the molecular formula C14H12N4 and a molecular weight of 236.28 g/mol. Its IUPAC name is 2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline.

Molecular Properties

Compound Name2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline
PubChem CID141174884
Molecular FormulaC14H12N4
Molecular Weight236.28 g/mol
Exact Mass236.11
IUPAC Name2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline
SMILESCc1ccc(-c2cnc3cccnc3n2)cc1N
InChIInChI=1S/C14H12N4/c1-9-4-5-10(7-11(9)15)13-8-17-12-3-2-6-16-14(12)18-13/h2-8H,15H2,1H3
InChIKeyKCLZHILGLLTQFN-UHFFFAOYSA-N
XLogP2.58
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-(4-iodophenyl)pyrido[2,3-b]pyrazine
CID 118796574
3-(1-methylimidazol-4-yl)pyrido[2,3-b]pyrazine
CID 141348292
5-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylaniline
CID 63758337
2-methyl-5-(2-pyridin-2-ylphenyl)aniline
CID 135030637
5-(1,3-benzothiazol-2-yl)-2-methylaniline
CID 735970
3-[(4-pyrido[2,3-b]pyrazin-3-ylpyrazol-1-yl)methyl]aniline
CID 141348313
6-quinolin-6-ylpyrazin-2-amine
CID 81222208
2-methyl-5-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)aniline
CID 66487228
2-methyl-5-([1,2,4]triazolo[4,3-a]pyrimidin-3-yl)aniline
CID 43628629
4-methyl-1,8-naphthyridin-2-amine
CID 23008692
N-(2-methylphenyl)pyrido[2,3-b]pyrazin-3-amine
CID 141174857
2-(4-bromophenyl)pyrido[2,3-b]pyrazine
CID 5302464

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline?
The IUPAC name of 2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline (CID 141174884) is 2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline.
What is the SMILES notation for 2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline?
The canonical SMILES for 2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline is Cc1ccc(-c2cnc3cccnc3n2)cc1N.
What is the InChIKey of 2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline?
The InChIKey is KCLZHILGLLTQFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4/c1-9-4-5-10(7-11(9)15)13-8-17-12-3-2-6-16-14(12)18-13/h2-8H,15H2,1H3.
What are the key properties of 2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline?
2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline has a molecular weight of 236.28 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-pyrido[2,3-b]pyrazin-3-ylaniline is sourced from PubChem (CID 141174884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).