2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile

C16H17N3O — CID 653098

IUPAC2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile
SMILESCCc1nc(N)c(C#N)c(-c2ccccc2OC)c1C
InChIInChI=1S/C16H17N3O/c1-4-13-10(2)15(12(9-17)16(18)19-13)11-7-5-6-8-14(11)20-3/h5-8H,4H2,1-3H3,(H2,18,19)
InChIKeyNPJNUVCVZSSZHP-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.08
Rot. Bonds3

About 2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile

2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile (PubChem CID 653098) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile
PubChem CID653098
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile
SMILESCCc1nc(N)c(C#N)c(-c2ccccc2OC)c1C
InChIInChI=1S/C16H17N3O/c1-4-13-10(2)15(12(9-17)16(18)19-13)11-7-5-6-8-14(11)20-3/h5-8H,4H2,1-3H3,(H2,18,19)
InChIKeyNPJNUVCVZSSZHP-UHFFFAOYSA-N
XLogP3.08
TPSA71.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2-(3'-Methoxybiphenyl-3-YL)ethyl)pyridin-2-amine
CID 11659487
2-Amino-6-(4-methoxyphenyl)-5-methyl-4-pyridin-3-ylpyridine-3-carbonitrile
CID 934596
2-Amino-6-(4-hydroxy-phenyl)-4-(4-methoxy-phenyl)-nicotinonitrile
CID 856248
6-Ethyl-5-(3-methoxy-phenyl)-pyrimidine-2,4-diamine
CID 10466996
4-Methoxymethyl-2-(2-methoxy-phenylamino)-6-methyl-nicotinonitrile
CID 747288
2-Amino-6-cyclopropyl-4-(4-methoxyphenyl)nicotinonitrile
CID 748928
2-(4-Methoxy-benzylamino)-4,6-dimethyl-nicotinonitrile
CID 975783
2-Amino-4-(2,5-dimethoxyphenyl)-6-pyridin-3-ylpyridine-3-carbonitrile
CID 1849298
2-Amino-4-(2-methoxyphenyl)-5,6-dihydrobenzo[h]quinoline-3-carbonitrile
CID 856333
2-Methoxy-6-(4-methoxyphenyl)pyridine-3-carbonitrile
CID 2768879
2-Pyridinamine, 6-[4-[2-(dimethylamino)ethyl]-5-ethyl-2-methoxyphenyl]-
CID 44393630
6-[4-(3-Dimethylamino-propyl)-2,5-dimethoxy-phenyl]-pyridin-2-ylamine
CID 44393639

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile (CID 653098) is 2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile is CCc1nc(N)c(C#N)c(-c2ccccc2OC)c1C.
What is the InChIKey of 2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile?
The InChIKey is NPJNUVCVZSSZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-4-13-10(2)15(12(9-17)16(18)19-13)11-7-5-6-8-14(11)20-3/h5-8H,4H2,1-3H3,(H2,18,19).
What are the key properties of 2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile?
2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile has a molecular weight of 267.33 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-ethyl-4-(2-methoxyphenyl)-5-methylpyridine-3-carbonitrile is sourced from PubChem (CID 653098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).