5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile

C15H16N4O — CID 106259794

IUPAC5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile
SMILESCOc1ccccc1CCNc1ncc(C#N)cc1N
InChIInChI=1S/C15H16N4O/c1-20-14-5-3-2-4-12(14)6-7-18-15-13(17)8-11(9-16)10-19-15/h2-5,8,10H,6-7,17H2,1H3,(H,18,19)
InChIKeyCRJBTTLUZHYZRV-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.20
Rot. Bonds5

About 5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile

5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile (PubChem CID 106259794) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile
PubChem CID106259794
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile
SMILESCOc1ccccc1CCNc1ncc(C#N)cc1N
InChIInChI=1S/C15H16N4O/c1-20-14-5-3-2-4-12(14)6-7-18-15-13(17)8-11(9-16)10-19-15/h2-5,8,10H,6-7,17H2,1H3,(H,18,19)
InChIKeyCRJBTTLUZHYZRV-UHFFFAOYSA-N
XLogP2.20
TPSA83.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-6-[2-(2-methylphenyl)ethylamino]pyridine-3-carbonitrile
CID 103468756
5-amino-6-(2-pyridin-3-ylethylamino)pyridine-3-carbonitrile
CID 103467700
5-amino-6-[2-(2-methoxyethoxy)ethylamino]pyridine-3-carbonitrile
CID 103468093
5-amino-6-(2-ethoxyethylamino)pyridine-3-carbonitrile
CID 103467671
5-amino-6-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]pyridine-3-carbonitrile
CID 106414189
3-chloro-4-[2-(2-methoxyphenyl)ethylamino]benzonitrile
CID 106261278
5-amino-6-(2-phenylpropylamino)pyridine-3-carbonitrile
CID 103469065
N-[2-(2-methoxyphenyl)ethyl]-6-(2-methylpyrimidin-5-yl)pyrimidin-4-amine
CID 123915678
5-amino-6-[2-(cyclopenten-1-yl)ethylamino]pyridine-3-carbonitrile
CID 106166022
5-amino-6-(cyclobutylmethylamino)pyridine-3-carbonitrile
CID 103467531
5-bromo-6-hydrazinyl-N-[2-(2-methoxyphenyl)ethyl]pyrimidin-4-amine
CID 106262742
6-[(2-methoxyphenyl)methylamino]-1,7-naphthyridine-3-carbonitrile
CID 174544133

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile?
The IUPAC name of 5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile (CID 106259794) is 5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile.
What is the SMILES notation for 5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile?
The canonical SMILES for 5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile is COc1ccccc1CCNc1ncc(C#N)cc1N.
What is the InChIKey of 5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile?
The InChIKey is CRJBTTLUZHYZRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-20-14-5-3-2-4-12(14)6-7-18-15-13(17)8-11(9-16)10-19-15/h2-5,8,10H,6-7,17H2,1H3,(H,18,19).
What are the key properties of 5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile?
5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile has a molecular weight of 268.32 g/mol, XLogP of 2.20, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carbonitrile is sourced from PubChem (CID 106259794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).