4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine

C24H19N7O — CID 148760119

IUPAC4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine
SMILESCOc1ccc(-c2nc(Nc3cc(-c4ccccc4)[nH]n3)nc(-c3ccncc3)n2)cc1
InChIInChI=1S/C24H19N7O/c1-32-19-9-7-17(8-10-19)22-27-23(18-11-13-25-14-12-18)29-24(28-22)26-21-15-20(30-31-21)16-5-3-2-4-6-16/h2-15H,1H3,(H2,26,27,28,29,30,31)
InChIKeyOGJRWXCKNGXUIJ-UHFFFAOYSA-N
MW421.46 g/mol
LogP4.74
Rot. Bonds6

About 4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine

4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine (PubChem CID 148760119) has the molecular formula C24H19N7O and a molecular weight of 421.46 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine
PubChem CID148760119
Molecular FormulaC24H19N7O
Molecular Weight421.46 g/mol
Exact Mass421.17
IUPAC Name4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine
SMILESCOc1ccc(-c2nc(Nc3cc(-c4ccccc4)[nH]n3)nc(-c3ccncc3)n2)cc1
InChIInChI=1S/C24H19N7O/c1-32-19-9-7-17(8-10-19)22-27-23(18-11-13-25-14-12-18)29-24(28-22)26-21-15-20(30-31-21)16-5-3-2-4-6-16/h2-15H,1H3,(H2,26,27,28,29,30,31)
InChIKeyOGJRWXCKNGXUIJ-UHFFFAOYSA-N
XLogP4.74
TPSA101.50 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.46
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-methyl-2-phenyl-N-(5-phenyl-1H-pyrazol-3-yl)pyrimidin-4-amine
CID 10131417
2-(4-methoxyphenyl)-4,6-diphenylpyrimidine
CID 12706669
6-N-[(4-methoxyphenyl)methyl]-2-phenyl-4-N-(pyridin-4-ylmethyl)pyrimidine-4,6-diamine
CID 112881287
6-methoxy-N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-2-pyridin-3-ylquinazolin-4-amine
CID 71180169
5-[4-(2,4-dimethoxyphenyl)phenyl]-N-phenyl-1H-pyrazol-3-amine
CID 59989230
3-(benzenesulfonyl)-6-chloro-N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]pyridin-2-amine
CID 118628250
2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine
CID 139220875
6-methyl-2-[(4-methylphenoxy)methyl]-N-(5-phenyl-1H-pyrazol-3-yl)pyrimidin-4-amine
CID 70949618
N-[5-(3,5-dichlorophenyl)-1H-pyrazol-3-yl]-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
CID 71273676
2-(4-anilino-6-phenyl-1,3,5-triazin-2-yl)-5-methoxyphenol
CID 136603035
2-(4-methoxyphenyl)-4,6-diphenyl-1,3,5-triazine;prop-1-en-2-ol
CID 142176460
4-[2-(4-methoxyphenyl)phenyl]pyridine
CID 173342516

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine (CID 148760119) is 4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine is COc1ccc(-c2nc(Nc3cc(-c4ccccc4)[nH]n3)nc(-c3ccncc3)n2)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is OGJRWXCKNGXUIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N7O/c1-32-19-9-7-17(8-10-19)22-27-23(18-11-13-25-14-12-18)29-24(28-22)26-21-15-20(30-31-21)16-5-3-2-4-6-16/h2-15H,1H3,(H2,26,27,28,29,30,31).
What are the key properties of 4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine?
4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 421.46 g/mol, XLogP of 4.74, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 148760119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).