3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile

C15H24N4O2 — CID 63285621

IUPAC3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile
SMILESCOCCN(CCC#N)c1ccc(N)c(OC(C)(C)C)n1
InChIInChI=1S/C15H24N4O2/c1-15(2,3)21-14-12(17)6-7-13(18-14)19(9-5-8-16)10-11-20-4/h6-7H,5,9-11,17H2,1-4H3
InChIKeyJJSZGBMCFGMHSW-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.21
Rot. Bonds7

About 3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile

3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile (PubChem CID 63285621) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile.

Molecular Properties

Compound Name3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile
PubChem CID63285621
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile
SMILESCOCCN(CCC#N)c1ccc(N)c(OC(C)(C)C)n1
InChIInChI=1S/C15H24N4O2/c1-15(2,3)21-14-12(17)6-7-13(18-14)19(9-5-8-16)10-11-20-4/h6-7H,5,9-11,17H2,1-4H3
InChIKeyJJSZGBMCFGMHSW-UHFFFAOYSA-N
XLogP2.21
TPSA84.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-[(5-amino-6-propoxy-2-pyridinyl)-(2-methoxyethyl)amino]propanenitrile
CID 63285578
2-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-hydroxyethyl)amino]ethanol
CID 61242801
2-N-methyl-6-[(2-methylpropan-2-yl)oxy]-2-N-propylpyridine-2,5-diamine
CID 43270938
6-[2-cyanoethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile
CID 64587966
2-N-methoxy-2-N-methyl-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 43627557
2-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 62843269
3-[6-amino-2,3-difluoro-N-(2-methoxyethyl)anilino]propanenitrile
CID 63285147
2-N-ethyl-2-N-(2-ethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 43587829
3-[2-methoxyethyl(pyridazin-3-yl)amino]propanenitrile
CID 63286635
3-[(6-chloropyrazin-2-yl)-(2-methoxyethyl)amino]propanenitrile
CID 63286441
3-[3-amino-N-(2-methoxyethyl)-4-methylanilino]propanenitrile
CID 63285271
3-[(2-chloro-6-methylpyrimidin-4-yl)-(2-methoxyethyl)amino]propanenitrile
CID 63286901

Frequently Asked Questions

What is the IUPAC name of 3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile?
The IUPAC name of 3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile (CID 63285621) is 3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile.
What is the SMILES notation for 3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile?
The canonical SMILES for 3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile is COCCN(CCC#N)c1ccc(N)c(OC(C)(C)C)n1.
What is the InChIKey of 3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile?
The InChIKey is JJSZGBMCFGMHSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-15(2,3)21-14-12(17)6-7-13(18-14)19(9-5-8-16)10-11-20-4/h6-7H,5,9-11,17H2,1-4H3.
What are the key properties of 3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile?
3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile has a molecular weight of 292.38 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-(2-methoxyethyl)amino]propanenitrile is sourced from PubChem (CID 63285621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).