N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine

C22H15N5S2 — CID 140790959

IUPACN-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine
SMILESc1ccc(N(c2cccc(-c3nccs3)n2)c2cccc(-c3nccs3)n2)cc1
InChIInChI=1S/C22H15N5S2/c1-2-6-16(7-3-1)27(19-10-4-8-17(25-19)21-23-12-14-28-21)20-11-5-9-18(26-20)22-24-13-15-29-22/h1-15H
InChIKeyOVQGQNNDFHFZIC-UHFFFAOYSA-N
MW413.53 g/mol
LogP6.19
Rot. Bonds5

About N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine

N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine (PubChem CID 140790959) has the molecular formula C22H15N5S2 and a molecular weight of 413.53 g/mol. Its IUPAC name is N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine.

Molecular Properties

Compound NameN-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine
PubChem CID140790959
Molecular FormulaC22H15N5S2
Molecular Weight413.53 g/mol
Exact Mass413.08
IUPAC NameN-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine
SMILESc1ccc(N(c2cccc(-c3nccs3)n2)c2cccc(-c3nccs3)n2)cc1
InChIInChI=1S/C22H15N5S2/c1-2-6-16(7-3-1)27(19-10-4-8-17(25-19)21-23-12-14-28-21)20-11-5-9-18(26-20)22-24-13-15-29-22/h1-15H
InChIKeyOVQGQNNDFHFZIC-UHFFFAOYSA-N
XLogP6.19
TPSA54.80 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500413.53
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine with MolForge

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Related Compounds

2-(6-ethoxy-2-pyridinyl)-1,3-thiazole
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N-phenyl-6-(2H-pyrrol-2-id-1-yl)-N-[3-(1,3-thiazol-2-yl)benzene-2-id-1-yl]pyridin-2-amine;platinum(2+)
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N-(5-ethyl-2-pyridinyl)-6-(1,3-thiazol-2-yl)pyridin-2-amine
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platinum;2-[4-[6-(N-pyridin-2-ylanilino)-2-pyridinyl]-3H-pyridin-3-id-2-yl]phenol
CID 153280501
N-(5-propyl-2-pyridinyl)-6-(1,3-thiazol-2-yl)pyridin-2-amine
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CID 158437520
CID 158437520
N-phenyl-6-pyridin-2-yl-N-(3-pyrrol-1-ylphenyl)pyridin-2-amine
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Frequently Asked Questions

What is the IUPAC name of N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine?
The IUPAC name of N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine (CID 140790959) is N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine.
What is the SMILES notation for N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine?
The canonical SMILES for N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine is c1ccc(N(c2cccc(-c3nccs3)n2)c2cccc(-c3nccs3)n2)cc1.
What is the InChIKey of N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine?
The InChIKey is OVQGQNNDFHFZIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N5S2/c1-2-6-16(7-3-1)27(19-10-4-8-17(25-19)21-23-12-14-28-21)20-11-5-9-18(26-20)22-24-13-15-29-22/h1-15H.
What are the key properties of N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine?
N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine has a molecular weight of 413.53 g/mol, XLogP of 6.19, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-6-(1,3-thiazol-2-yl)-N-[6-(1,3-thiazol-2-yl)-2-pyridinyl]pyridin-2-amine is sourced from PubChem (CID 140790959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).