2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile

C22H21N3O — CID 3464758

IUPAC2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile
SMILESCCOc1ccccc1-c1cc(-c2ccc(C)cc2C)nc(N)c1C#N
InChIInChI=1S/C22H21N3O/c1-4-26-21-8-6-5-7-17(21)18-12-20(25-22(24)19(18)13-23)16-10-9-14(2)11-15(16)3/h5-12H,4H2,1-3H3,(H2,24,25)
InChIKeyBCPPZMYKVGSHDV-UHFFFAOYSA-N
MW343.43 g/mol
LogP4.89
Rot. Bonds4

About 2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile

2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile (PubChem CID 3464758) has the molecular formula C22H21N3O and a molecular weight of 343.43 g/mol. Its IUPAC name is 2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile
PubChem CID3464758
Molecular FormulaC22H21N3O
Molecular Weight343.43 g/mol
Exact Mass343.17
IUPAC Name2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile
SMILESCCOc1ccccc1-c1cc(-c2ccc(C)cc2C)nc(N)c1C#N
InChIInChI=1S/C22H21N3O/c1-4-26-21-8-6-5-7-17(21)18-12-20(25-22(24)19(18)13-23)16-10-9-14(2)11-15(16)3/h5-12H,4H2,1-3H3,(H2,24,25)
InChIKeyBCPPZMYKVGSHDV-UHFFFAOYSA-N
XLogP4.89
TPSA71.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-4-(2-ethoxyphenyl)-6-(4-methoxyphenyl)pyridine-3-carbonitrile
CID 3371240
2-amino-6-(2,4-dimethylphenyl)-4-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
CID 3464753
2-amino-4-(2,5-dimethylphenyl)-6-(2-methylphenyl)pyridine-3-carbonitrile
CID 5230497
2-amino-6-(2,4-dimethylphenyl)-4-(4-phenylmethoxyphenyl)pyridine-3-carbonitrile
CID 3470401
2-amino-6-(2,4-dimethylphenyl)-4-(furan-2-yl)pyridine-3-carbonitrile
CID 3480329
2-amino-4,6-bis(2,5-dimethylphenyl)pyridine-3-carbonitrile
CID 3513608
2-(2-ethoxyphenyl)-5-methylaniline
CID 82766449
2-amino-4-(5-bromo-2-ethoxyphenyl)-6-(2-nitrophenyl)pyridine-3-carbonitrile
CID 5229296
2-amino-4-(4-ethoxyphenyl)-6-(4-methylphenyl)pyridine-3-carbonitrile
CID 3363551
2-amino-6-(4-bromophenyl)-4-(2,4-dimethylphenyl)pyridine-3-carbonitrile
CID 3396959
2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile
CID 3351973
2-amino-6-(2,4-dichlorophenyl)-4-(2-methylphenyl)pyridine-3-carbonitrile
CID 3389205

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile (CID 3464758) is 2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile is CCOc1ccccc1-c1cc(-c2ccc(C)cc2C)nc(N)c1C#N.
What is the InChIKey of 2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile?
The InChIKey is BCPPZMYKVGSHDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O/c1-4-26-21-8-6-5-7-17(21)18-12-20(25-22(24)19(18)13-23)16-10-9-14(2)11-15(16)3/h5-12H,4H2,1-3H3,(H2,24,25).
What are the key properties of 2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile?
2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile has a molecular weight of 343.43 g/mol, XLogP of 4.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile is sourced from PubChem (CID 3464758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).