N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide

C16H15N3O2 — CID 46550839

IUPACN-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide
SMILESCC(c1cc2ccccc2o1)N(C)C(=O)c1cnccn1
InChIInChI=1S/C16H15N3O2/c1-11(15-9-12-5-3-4-6-14(12)21-15)19(2)16(20)13-10-17-7-8-18-13/h3-11H,1-2H3
InChIKeyCHCRHVJUVSSPPT-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.06
Rot. Bonds3

About N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide

N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide (PubChem CID 46550839) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide
PubChem CID46550839
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC NameN-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide
SMILESCC(c1cc2ccccc2o1)N(C)C(=O)c1cnccn1
InChIInChI=1S/C16H15N3O2/c1-11(15-9-12-5-3-4-6-14(12)21-15)19(2)16(20)13-10-17-7-8-18-13/h3-11H,1-2H3
InChIKeyCHCRHVJUVSSPPT-UHFFFAOYSA-N
XLogP3.06
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyridine-4-carboxamide
CID 46551068
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]pyrazine-2-carboxamide
CID 26007494
N-[1-(2-hydroxyphenyl)ethyl]-N-methylpyrazine-2-carboxamide
CID 54913010
N-[1-(1-benzofuran-2-yl)ethyl]-N,4-dimethylbenzamide
CID 46551169
N-[1-(1-benzofuran-2-yl)ethyl]-N,5-dimethylfuran-2-carboxamide
CID 46551065
N-[1-(1-benzofuran-2-yl)ethyl]-5-bromo-N-methylfuran-2-carboxamide
CID 46551193
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-N-methyl-1H-indole-2-carboxamide
CID 39976177
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-3,4-difluoro-N-methylbenzamide
CID 39976580
N-[1-(1-benzofuran-2-yl)ethyl]-4-ethoxy-N-methylbenzamide
CID 46550865
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-N-methyl-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide
CID 94571557
N-[1-(1-benzofuran-2-yl)ethyl]-N,1,3-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-7-carboxamide
CID 134054336
N-[1-(1-benzofuran-2-yl)ethyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-methylacetamide
CID 111336371

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide?
The IUPAC name of N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide (CID 46550839) is N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide.
What is the SMILES notation for N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide?
The canonical SMILES for N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide is CC(c1cc2ccccc2o1)N(C)C(=O)c1cnccn1.
What is the InChIKey of N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide?
The InChIKey is CHCRHVJUVSSPPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-11(15-9-12-5-3-4-6-14(12)21-15)19(2)16(20)13-10-17-7-8-18-13/h3-11H,1-2H3.
What are the key properties of N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide?
N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide has a molecular weight of 281.31 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-benzofuran-2-yl)ethyl]-N-methylpyrazine-2-carboxamide is sourced from PubChem (CID 46550839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).