2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine

C23H19N7 — CID 139220875

IUPAC2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine
SMILESc1ccc(-c2cc(Nc3cccc(Nc4cc(-c5ccccc5)[nH]n4)n3)n[nH]2)cc1
InChIInChI=1S/C23H19N7/c1-3-8-16(9-4-1)18-14-22(29-27-18)25-20-12-7-13-21(24-20)26-23-15-19(28-30-23)17-10-5-2-6-11-17/h1-15H,(H4,24,25,26,27,28,29,30)
InChIKeyHNSNOAJWOUPMGU-UHFFFAOYSA-N
MW393.45 g/mol
LogP5.35
Rot. Bonds6

About 2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine

2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine (PubChem CID 139220875) has the molecular formula C23H19N7 and a molecular weight of 393.45 g/mol. Its IUPAC name is 2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine
PubChem CID139220875
Molecular FormulaC23H19N7
Molecular Weight393.45 g/mol
Exact Mass393.17
IUPAC Name2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine
SMILESc1ccc(-c2cc(Nc3cccc(Nc4cc(-c5ccccc5)[nH]n4)n3)n[nH]2)cc1
InChIInChI=1S/C23H19N7/c1-3-8-16(9-4-1)18-14-22(29-27-18)25-20-12-7-13-21(24-20)26-23-15-19(28-30-23)17-10-5-2-6-11-17/h1-15H,(H4,24,25,26,27,28,29,30)
InChIKeyHNSNOAJWOUPMGU-UHFFFAOYSA-N
XLogP5.35
TPSA94.31 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.45
LogP ≤ 55.35
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-2-phenyl-N-(5-phenyl-1H-pyrazol-3-yl)pyrimidin-4-amine
CID 10131417
(5-phenyl-1H-pyrazol-3-yl)hydrazine
CID 13016518
N,N'-bis(5-phenyl-1H-pyrazol-3-yl)ethane-1,2-diamine;dihydrochloride
CID 162315025
4-N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-1-N-phenylbenzene-1,4-diamine
CID 139405714
6-methyl-2-[(4-methylphenoxy)methyl]-N-(5-phenyl-1H-pyrazol-3-yl)pyrimidin-4-amine
CID 70949618
N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-6-methyl-4-phenylsulfanylpyridin-2-amine
CID 144988150
6-chloro-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-1-ylsulfanylpyridin-2-amine
CID 144988121
N-butan-2-yl-5-phenyl-1H-pyrazol-3-amine
CID 71102325
6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-piperidin-4-ylsulfanylpyridin-2-amine
CID 144988036
3-hydroxy-N-(5-phenyl-1H-pyrazol-3-yl)benzamide
CID 110472399
4-(4-methoxyphenyl)-N-(5-phenyl-1H-pyrazol-3-yl)-6-pyridin-4-yl-1,3,5-triazin-2-amine
CID 148760119
N-(5-phenyl-1H-pyrazol-3-yl)butanamide
CID 110868179

Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine?
The IUPAC name of 2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine (CID 139220875) is 2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine.
What is the SMILES notation for 2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine?
The canonical SMILES for 2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine is c1ccc(-c2cc(Nc3cccc(Nc4cc(-c5ccccc5)[nH]n4)n3)n[nH]2)cc1.
What is the InChIKey of 2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine?
The InChIKey is HNSNOAJWOUPMGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N7/c1-3-8-16(9-4-1)18-14-22(29-27-18)25-20-12-7-13-21(24-20)26-23-15-19(28-30-23)17-10-5-2-6-11-17/h1-15H,(H4,24,25,26,27,28,29,30).
What are the key properties of 2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine?
2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine has a molecular weight of 393.45 g/mol, XLogP of 5.35, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-bis(5-phenyl-1H-pyrazol-3-yl)pyridine-2,6-diamine is sourced from PubChem (CID 139220875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).