N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide

C16H16N4O — CID 146080613

IUPACN-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide
SMILESCc1cncc(C(=O)NCCc2c[nH]c3ccccc23)n1
InChIInChI=1S/C16H16N4O/c1-11-8-17-10-15(20-11)16(21)18-7-6-12-9-19-14-5-3-2-4-13(12)14/h2-5,8-10,19H,6-7H2,1H3,(H,18,21)
InChIKeyNYYHLDGDJMYNGF-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.24
Rot. Bonds4

About N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide

N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide (PubChem CID 146080613) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide
PubChem CID146080613
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC NameN-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide
SMILESCc1cncc(C(=O)NCCc2c[nH]c3ccccc23)n1
InChIInChI=1S/C16H16N4O/c1-11-8-17-10-15(20-11)16(21)18-7-6-12-9-19-14-5-3-2-4-13(12)14/h2-5,8-10,19H,6-7H2,1H3,(H,18,21)
InChIKeyNYYHLDGDJMYNGF-UHFFFAOYSA-N
XLogP2.24
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-N-[2-(1H-indol-3-yl)ethyl]pyrazine-2-carboxamide
CID 103186743
N-[2-(1H-indol-3-yl)ethyl]-2,4,6-trimethylpyrimidine-5-carboxamide
CID 110853427
N-[2-(1H-indol-3-yl)ethyl]-4-methyl-1,3-thiazole-2-carboxamide
CID 110696129
N-[2-(1H-indol-3-yl)ethyl]-2-methyl-1H-pyrrole-3-carboxamide
CID 110695717
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811
N-[2-(1H-indol-3-yl)ethyl]-5-methyl-1,2-thiazole-3-carboxamide
CID 84576677
N-[2-(1H-indol-3-yl)ethyl]-2-methyltriazole-4-carboxamide
CID 110691403
N-[2-(1H-indol-3-yl)ethyl]-1-methyltriazole-4-carboxamide
CID 45497188
6-N-[2-(dimethylamino)ethyl]-2-N-[2-(1H-indol-3-yl)ethyl]pyridine-2,6-dicarboxamide
CID 109096308
N-[2-(1H-indol-3-yl)ethyl]-2-methyl-1,3-thiazole-5-carboxamide
CID 110853376
5-N-benzyl-3-N-[2-(1H-indol-3-yl)ethyl]pyridine-3,5-dicarboxamide
CID 109104994
N-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-(2-methylpropylamino)pyrimidine-4-carboxamide
CID 109320846

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide?
The IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide (CID 146080613) is N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide.
What is the SMILES notation for N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide?
The canonical SMILES for N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide is Cc1cncc(C(=O)NCCc2c[nH]c3ccccc23)n1.
What is the InChIKey of N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide?
The InChIKey is NYYHLDGDJMYNGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-11-8-17-10-15(20-11)16(21)18-7-6-12-9-19-14-5-3-2-4-13(12)14/h2-5,8-10,19H,6-7H2,1H3,(H,18,21).
What are the key properties of N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide?
N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)ethyl]-6-methylpyrazine-2-carboxamide is sourced from PubChem (CID 146080613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).