6-amino-3-methoxypyridine-2-carbonitrile

C7H7N3O — CID 118607484

IUPAC6-amino-3-methoxypyridine-2-carbonitrile
SMILESCOc1ccc(N)nc1C#N
InChIInChI=1S/C7H7N3O/c1-11-6-2-3-7(9)10-5(6)4-8/h2-3H,1H3,(H2,9,10)
InChIKeyGIZQEGXBZVWTJJ-UHFFFAOYSA-N
MW149.15 g/mol
LogP0.54
Rot. Bonds1

About 6-amino-3-methoxypyridine-2-carbonitrile

6-amino-3-methoxypyridine-2-carbonitrile (PubChem CID 118607484) has the molecular formula C7H7N3O and a molecular weight of 149.15 g/mol. Its IUPAC name is 6-amino-3-methoxypyridine-2-carbonitrile.

Molecular Properties

Compound Name6-amino-3-methoxypyridine-2-carbonitrile
PubChem CID118607484
Molecular FormulaC7H7N3O
Molecular Weight149.15 g/mol
Exact Mass149.06
IUPAC Name6-amino-3-methoxypyridine-2-carbonitrile
SMILESCOc1ccc(N)nc1C#N
InChIInChI=1S/C7H7N3O/c1-11-6-2-3-7(9)10-5(6)4-8/h2-3H,1H3,(H2,9,10)
InChIKeyGIZQEGXBZVWTJJ-UHFFFAOYSA-N
XLogP0.54
TPSA71.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-3-methoxypyridine-2-carbonitrile?
The IUPAC name of 6-amino-3-methoxypyridine-2-carbonitrile (CID 118607484) is 6-amino-3-methoxypyridine-2-carbonitrile.
What is the SMILES notation for 6-amino-3-methoxypyridine-2-carbonitrile?
The canonical SMILES for 6-amino-3-methoxypyridine-2-carbonitrile is COc1ccc(N)nc1C#N.
What is the InChIKey of 6-amino-3-methoxypyridine-2-carbonitrile?
The InChIKey is GIZQEGXBZVWTJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O/c1-11-6-2-3-7(9)10-5(6)4-8/h2-3H,1H3,(H2,9,10).
What are the key properties of 6-amino-3-methoxypyridine-2-carbonitrile?
6-amino-3-methoxypyridine-2-carbonitrile has a molecular weight of 149.15 g/mol, XLogP of 0.54, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-methoxypyridine-2-carbonitrile is sourced from PubChem (CID 118607484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).