2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile

C10H6BrN3S — CID 62197435

IUPAC2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(-c2ccc(Br)s2)nc1N
InChIInChI=1S/C10H6BrN3S/c11-9-4-3-8(15-9)7-2-1-6(5-12)10(13)14-7/h1-4H,(H2,13,14)
InChIKeyCWATWLZXDQEZQX-UHFFFAOYSA-N
MW280.15 g/mol
LogP3.03
Rot. Bonds1

About 2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile

2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile (PubChem CID 62197435) has the molecular formula C10H6BrN3S and a molecular weight of 280.15 g/mol. Its IUPAC name is 2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile
PubChem CID62197435
Molecular FormulaC10H6BrN3S
Molecular Weight280.15 g/mol
Exact Mass278.95
IUPAC Name2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(-c2ccc(Br)s2)nc1N
InChIInChI=1S/C10H6BrN3S/c11-9-4-3-8(15-9)7-2-1-6(5-12)10(13)14-7/h1-4H,(H2,13,14)
InChIKeyCWATWLZXDQEZQX-UHFFFAOYSA-N
XLogP3.03
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.15
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile (CID 62197435) is 2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile is N#Cc1ccc(-c2ccc(Br)s2)nc1N.
What is the InChIKey of 2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile?
The InChIKey is CWATWLZXDQEZQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrN3S/c11-9-4-3-8(15-9)7-2-1-6(5-12)10(13)14-7/h1-4H,(H2,13,14).
What are the key properties of 2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile?
2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile has a molecular weight of 280.15 g/mol, XLogP of 3.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(5-bromothiophen-2-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 62197435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).