5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile

C13H20N4O2 — CID 103468022

IUPAC5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile
SMILESCOCCN(c1ncc(C#N)cc1N)C(C)COC
InChIInChI=1S/C13H20N4O2/c1-10(9-19-3)17(4-5-18-2)13-12(15)6-11(7-14)8-16-13/h6,8,10H,4-5,9,15H2,1-3H3
InChIKeyUNSDIYXGNGKLBZ-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.02
Rot. Bonds7

About 5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile

5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile (PubChem CID 103468022) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile
PubChem CID103468022
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile
SMILESCOCCN(c1ncc(C#N)cc1N)C(C)COC
InChIInChI=1S/C13H20N4O2/c1-10(9-19-3)17(4-5-18-2)13-12(15)6-11(7-14)8-16-13/h6,8,10H,4-5,9,15H2,1-3H3
InChIKeyUNSDIYXGNGKLBZ-UHFFFAOYSA-N
XLogP1.02
TPSA84.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-3-carbonitrile
CID 103468029
5-amino-6-[pentyl(propan-2-yl)amino]pyridine-3-carbonitrile
CID 103468013
3-bromo-2-N-(2-methoxyethyl)-2-N-(1-methoxypropan-2-yl)pyridine-2,5-diamine
CID 79535258
5-chloro-2-N-(2-methoxyethyl)-2-N-propan-2-ylpyridine-2,3-diamine
CID 82949133
5-amino-6-[benzyl(propan-2-yl)amino]pyridine-3-carbonitrile
CID 103467234
5-amino-2-[ethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile
CID 55010953
2-N-(2-methoxyethyl)-2-N-(1-methoxypropan-2-yl)-4-methylpyridine-2,5-diamine
CID 79175638
6-chloro-4-N-(2-methoxyethyl)-4-N-(1-methoxypropan-2-yl)pyrimidine-4,5-diamine
CID 63024124
5-amino-6-[3-hydroxybutyl(methyl)amino]pyridine-3-carbonitrile
CID 103469180
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methyl-5-(methylaminomethyl)pyridin-2-amine
CID 80629569
4-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-2-carbonitrile
CID 55156482
3-fluoro-4-[2-methoxyethyl(1-methoxypropan-2-yl)amino]benzonitrile
CID 55004953

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile?
The IUPAC name of 5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile (CID 103468022) is 5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile.
What is the SMILES notation for 5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile?
The canonical SMILES for 5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile is COCCN(c1ncc(C#N)cc1N)C(C)COC.
What is the InChIKey of 5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile?
The InChIKey is UNSDIYXGNGKLBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-10(9-19-3)17(4-5-18-2)13-12(15)6-11(7-14)8-16-13/h6,8,10H,4-5,9,15H2,1-3H3.
What are the key properties of 5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile?
5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile has a molecular weight of 264.33 g/mol, XLogP of 1.02, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-[2-methoxyethyl(1-methoxypropan-2-yl)amino]pyridine-3-carbonitrile is sourced from PubChem (CID 103468022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).