2-pyrazin-2-yl-2,3-dihydro-1H-indole

C12H11N3 — CID 65042123

IUPAC2-pyrazin-2-yl-2,3-dihydro-1H-indole
SMILESc1ccc2c(c1)CC(c1cnccn1)N2
InChIInChI=1S/C12H11N3/c1-2-4-10-9(3-1)7-11(15-10)12-8-13-5-6-14-12/h1-6,8,11,15H,7H2
InChIKeyUUUSVZONQWHPBY-UHFFFAOYSA-N
MW197.24 g/mol
LogP2.19
Rot. Bonds1

About 2-pyrazin-2-yl-2,3-dihydro-1H-indole

2-pyrazin-2-yl-2,3-dihydro-1H-indole (PubChem CID 65042123) has the molecular formula C12H11N3 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-pyrazin-2-yl-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name2-pyrazin-2-yl-2,3-dihydro-1H-indole
PubChem CID65042123
Molecular FormulaC12H11N3
Molecular Weight197.24 g/mol
Exact Mass197.10
IUPAC Name2-pyrazin-2-yl-2,3-dihydro-1H-indole
SMILESc1ccc2c(c1)CC(c1cnccn1)N2
InChIInChI=1S/C12H11N3/c1-2-4-10-9(3-1)7-11(15-10)12-8-13-5-6-14-12/h1-6,8,11,15H,7H2
InChIKeyUUUSVZONQWHPBY-UHFFFAOYSA-N
XLogP2.19
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-pyrazin-2-yl-2,3-dihydro-1H-indole?
The IUPAC name of 2-pyrazin-2-yl-2,3-dihydro-1H-indole (CID 65042123) is 2-pyrazin-2-yl-2,3-dihydro-1H-indole.
What is the SMILES notation for 2-pyrazin-2-yl-2,3-dihydro-1H-indole?
The canonical SMILES for 2-pyrazin-2-yl-2,3-dihydro-1H-indole is c1ccc2c(c1)CC(c1cnccn1)N2.
What is the InChIKey of 2-pyrazin-2-yl-2,3-dihydro-1H-indole?
The InChIKey is UUUSVZONQWHPBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3/c1-2-4-10-9(3-1)7-11(15-10)12-8-13-5-6-14-12/h1-6,8,11,15H,7H2.
What are the key properties of 2-pyrazin-2-yl-2,3-dihydro-1H-indole?
2-pyrazin-2-yl-2,3-dihydro-1H-indole has a molecular weight of 197.24 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazin-2-yl-2,3-dihydro-1H-indole is sourced from PubChem (CID 65042123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).