N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine

C24H16ClFN4 — CID 10295308

IUPACN-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine
SMILESFc1ccc2[nH]nc(Nc3cc(-c4ccccc4)cc(-c4ccccc4Cl)n3)c2c1
InChIInChI=1S/C24H16ClFN4/c25-20-9-5-4-8-18(20)22-12-16(15-6-2-1-3-7-15)13-23(27-22)28-24-19-14-17(26)10-11-21(19)29-30-24/h1-14H,(H2,27,28,29,30)
InChIKeyIODNVQVAISKCJW-UHFFFAOYSA-N
MW414.87 g/mol
LogP6.83
Rot. Bonds4

About N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine

N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine (PubChem CID 10295308) has the molecular formula C24H16ClFN4 and a molecular weight of 414.87 g/mol. Its IUPAC name is N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine.

Molecular Properties

Compound NameN-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine
PubChem CID10295308
Molecular FormulaC24H16ClFN4
Molecular Weight414.87 g/mol
Exact Mass414.10
IUPAC NameN-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine
SMILESFc1ccc2[nH]nc(Nc3cc(-c4ccccc4)cc(-c4ccccc4Cl)n3)c2c1
InChIInChI=1S/C24H16ClFN4/c25-20-9-5-4-8-18(20)22-12-16(15-6-2-1-3-7-15)13-23(27-22)28-24-19-14-17(26)10-11-21(19)29-30-24/h1-14H,(H2,27,28,29,30)
InChIKeyIODNVQVAISKCJW-UHFFFAOYSA-N
XLogP6.83
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.87
LogP ≤ 56.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1H-Pyrazolo[3,4-d]pyrimidin-4-amine, N-(3-chlorophenyl)-3-phenyl-
CID 5327839
N-[2-(4-chlorophenyl)ethyl]-2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
CID 16010778
[2-(3-chlorophenylamino)-quinazolin-4-yl]-(5-methyl-2H-pyrazol-3-yl)-amine
CID 9924567
6-chloro-5-phenyl-N-pyridin-2-yl-1H-indazol-3-amine
CID 10426186
4-N-(4-methylphenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine
CID 11140796
N-(3-chlorophenyl)-5-fluoro-1H-indazol-3-amine
CID 25096271
6-(3-Amino-1H-indazol-6-yl)-N4-phenyl-2,4-pyrimidinediamine
CID 46215644
4-N-(4-chlorophenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine
CID 124093771
4-N-(4-fluorophenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine
CID 124093772
8-bromo-4-N-(4-chlorophenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine
CID 124093773
4-N-[4-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]quinoline-3,4-diamine
CID 124093774
8-chloro-4-N-(4-chlorophenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine
CID 124093781

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine?
The IUPAC name of N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine (CID 10295308) is N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine.
What is the SMILES notation for N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine?
The canonical SMILES for N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine is Fc1ccc2[nH]nc(Nc3cc(-c4ccccc4)cc(-c4ccccc4Cl)n3)c2c1.
What is the InChIKey of N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine?
The InChIKey is IODNVQVAISKCJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16ClFN4/c25-20-9-5-4-8-18(20)22-12-16(15-6-2-1-3-7-15)13-23(27-22)28-24-19-14-17(26)10-11-21(19)29-30-24/h1-14H,(H2,27,28,29,30).
What are the key properties of N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine?
N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine has a molecular weight of 414.87 g/mol, XLogP of 6.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-chlorophenyl)-4-phenyl-2-pyridinyl]-5-fluoro-1H-indazol-3-amine is sourced from PubChem (CID 10295308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).