[5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine

C14H14N4 — CID 82388674

IUPAC[5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine
SMILESCc1cccc2[nH]c(-c3cnc(CN)cn3)cc12
InChIInChI=1S/C14H14N4/c1-9-3-2-4-12-11(9)5-13(18-12)14-8-16-10(6-15)7-17-14/h2-5,7-8,18H,6,15H2,1H3
InChIKeyASPFYCCCICVYCS-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.39
Rot. Bonds2

About [5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine

[5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine (PubChem CID 82388674) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is [5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine.

Molecular Properties

Compound Name[5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine
PubChem CID82388674
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name[5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine
SMILESCc1cccc2[nH]c(-c3cnc(CN)cn3)cc12
InChIInChI=1S/C14H14N4/c1-9-3-2-4-12-11(9)5-13(18-12)14-8-16-10(6-15)7-17-14/h2-5,7-8,18H,6,15H2,1H3
InChIKeyASPFYCCCICVYCS-UHFFFAOYSA-N
XLogP2.39
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(2,7-dimethyl-1H-indol-3-yl)pyrazin-2-yl]methanamine
CID 82382269
[5-(6-fluoro-1H-indol-2-yl)pyrazin-2-yl]methanamine
CID 82387029
1-[5-(4-methyl-1H-indol-2-yl)-1H-imidazol-2-yl]ethanamine
CID 82387807
3-(4-methyl-1H-indol-2-yl)-1-phenylpyrazol-5-amine
CID 166849184
2-(4-methyl-1H-indol-2-yl)ethanamine
CID 28806674
2-[4-(4-methyl-1H-indol-2-yl)pyrazol-1-yl]ethanol
CID 166849185
2,4-dimethyl-1H-indole;ethane
CID 91303970
2-[5-(1H-indol-2-yl)pyrazin-2-yl]acetic acid
CID 82382099
2-amino-1-(4-methyl-1H-indol-2-yl)ethanone
CID 82405076
[6-(2,4-dimethyl-1H-indol-3-yl)-1,2,4-triazin-3-yl]methanamine
CID 82381880
5-methyl-1H-quinazolin-2-one
CID 90281623
N-cyclohexyl-5-methyl-6-(4-methyl-1H-indol-2-yl)pyrazin-2-amine
CID 144921273

Frequently Asked Questions

What is the IUPAC name of [5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine?
The IUPAC name of [5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine (CID 82388674) is [5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine.
What is the SMILES notation for [5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine?
The canonical SMILES for [5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine is Cc1cccc2[nH]c(-c3cnc(CN)cn3)cc12.
What is the InChIKey of [5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine?
The InChIKey is ASPFYCCCICVYCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-9-3-2-4-12-11(9)5-13(18-12)14-8-16-10(6-15)7-17-14/h2-5,7-8,18H,6,15H2,1H3.
What are the key properties of [5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine?
[5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine has a molecular weight of 238.29 g/mol, XLogP of 2.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(4-methyl-1H-indol-2-yl)pyrazin-2-yl]methanamine is sourced from PubChem (CID 82388674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).