2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile

C23H23N3O2 — CID 5088045

IUPAC2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile
SMILESCCCc1ccc(-c2cc(-c3cc(OC)ccc3OC)c(C#N)c(N)n2)cc1
InChIInChI=1S/C23H23N3O2/c1-4-5-15-6-8-16(9-7-15)21-13-18(20(14-24)23(25)26-21)19-12-17(27-2)10-11-22(19)28-3/h6-13H,4-5H2,1-3H3,(H2,25,26)
InChIKeyCFNUXMQIVKBFMP-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.84
Rot. Bonds6

About 2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile

2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile (PubChem CID 5088045) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile
PubChem CID5088045
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC Name2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile
SMILESCCCc1ccc(-c2cc(-c3cc(OC)ccc3OC)c(C#N)c(N)n2)cc1
InChIInChI=1S/C23H23N3O2/c1-4-5-15-6-8-16(9-7-15)21-13-18(20(14-24)23(25)26-21)19-12-17(27-2)10-11-22(19)28-3/h6-13H,4-5H2,1-3H3,(H2,25,26)
InChIKeyCFNUXMQIVKBFMP-UHFFFAOYSA-N
XLogP4.84
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-4-(4-cyanophenyl)-6-(2,5-dimethoxyphenyl)pyridine-3-carbonitrile
CID 3554219
2-amino-6-(4-methoxyphenyl)-4-(2,4,6-trimethoxyphenyl)pyridine-3-carbonitrile
CID 3375509
2-amino-4-(2,5-dimethoxyphenyl)-6-(2-hydroxyphenyl)pyridine-3-carbonitrile
CID 135496405
2-amino-6-(4-ethoxyphenyl)-4-(4-methoxyphenyl)pyridine-3-carbonitrile
CID 5259045
2-amino-4-(2-ethoxyphenyl)-6-(4-methoxyphenyl)pyridine-3-carbonitrile
CID 3371240
2-amino-6-(4-propylphenyl)-4-pyridin-3-ylpyridine-3-carbonitrile
CID 5088040
2-amino-4-(4-methoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile
CID 70111563
2-amino-4-(2-methoxyphenyl)-6-(4-phenylphenyl)pyridine-3-carbonitrile
CID 5231002
2-amino-4-(3-bromo-4-methoxyphenyl)-6-(4-ethoxyphenyl)pyridine-3-carbonitrile
CID 5241528
2-amino-4-(2,6-dichlorophenyl)-6-(2,5-dimethoxyphenyl)pyridine-3-carbonitrile
CID 3557233
2-amino-6-(4-methoxyphenyl)-4-(2,3,4,5,6-pentafluorophenyl)pyridine-3-carbonitrile
CID 3371344
2-amino-4-(4-methoxyphenyl)-6-pyridin-4-ylpyridine-3-carbonitrile
CID 4636662

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile (CID 5088045) is 2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile is CCCc1ccc(-c2cc(-c3cc(OC)ccc3OC)c(C#N)c(N)n2)cc1.
What is the InChIKey of 2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile?
The InChIKey is CFNUXMQIVKBFMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-4-5-15-6-8-16(9-7-15)21-13-18(20(14-24)23(25)26-21)19-12-17(27-2)10-11-22(19)28-3/h6-13H,4-5H2,1-3H3,(H2,25,26).
What are the key properties of 2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile?
2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile has a molecular weight of 373.46 g/mol, XLogP of 4.84, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(2,5-dimethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile is sourced from PubChem (CID 5088045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).