N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine

C14H15N3O — CID 114475837

IUPACN-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine
SMILESCc1ncc(NC2COc3ccccc32)nc1C
InChIInChI=1S/C14H15N3O/c1-9-10(2)16-14(7-15-9)17-12-8-18-13-6-4-3-5-11(12)13/h3-7,12H,8H2,1-2H3,(H,16,17)
InChIKeyYRDMAXKWECSCSE-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.64
Rot. Bonds2

About N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine

N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine (PubChem CID 114475837) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine
PubChem CID114475837
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine
SMILESCc1ncc(NC2COc3ccccc32)nc1C
InChIInChI=1S/C14H15N3O/c1-9-10(2)16-14(7-15-9)17-12-8-18-13-6-4-3-5-11(12)13/h3-7,12H,8H2,1-2H3,(H,16,17)
InChIKeyYRDMAXKWECSCSE-UHFFFAOYSA-N
XLogP2.64
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(2,3-dihydro-1-benzofuran-3-yl)-2-N-methylpyrimidine-2,4-diamine
CID 80835565
N-(2,3-dihydro-1-benzofuran-3-yl)-6-ethoxy-2-methylpyrimidin-4-amine
CID 66326930
4-N-(2,3-dihydro-1-benzofuran-3-yl)-6-N-methylpyrimidine-4,6-diamine
CID 80835656
N-(2,3-dihydro-1-benzofuran-3-yl)-5-methyl-1H-imidazol-2-amine
CID 106574438
4-N-(2,3-dihydro-1-benzofuran-3-yl)-5-fluoro-2-N-methylpyrimidine-2,4-diamine
CID 80835746
6-chloro-N-(2,3-dihydro-1-benzofuran-3-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80951585
4-N-(2,3-dihydro-1-benzofuran-3-yl)-2-N-methylpyridine-2,4-diamine
CID 113367866
5-(2,3-dihydro-1-benzofuran-3-ylamino)-3-methyl-1,2-thiazole-4-carbonitrile
CID 79375468
3-(2,3-dihydro-1-benzofuran-3-ylamino)-5,6-dimethylpyridazine-4-carbonitrile
CID 62065580
methyl 6-(2,3-dihydro-1-benzofuran-3-ylamino)pyridazine-3-carboxylate
CID 62064686
3-[(5,6-dimethylpyrazin-2-yl)amino]-1-methylpyrrolidine-2,5-dione
CID 114475935
5-N-(2,3-dihydro-1-benzofuran-3-yl)-1,2,4-thiadiazole-3,5-diamine
CID 66279227

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine?
The IUPAC name of N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine (CID 114475837) is N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine.
What is the SMILES notation for N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine?
The canonical SMILES for N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine is Cc1ncc(NC2COc3ccccc32)nc1C.
What is the InChIKey of N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine?
The InChIKey is YRDMAXKWECSCSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-9-10(2)16-14(7-15-9)17-12-8-18-13-6-4-3-5-11(12)13/h3-7,12H,8H2,1-2H3,(H,16,17).
What are the key properties of N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine?
N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine has a molecular weight of 241.29 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1-benzofuran-3-yl)-5,6-dimethylpyrazin-2-amine is sourced from PubChem (CID 114475837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).