N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine

C24H24N6S — CID 24831962

IUPACN-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine
SMILESCN1CCN(c2ccnc(Nc3ncc(-c4ccnc(-c5ccccc5)c4)s3)c2)CC1
InChIInChI=1S/C24H24N6S/c1-29-11-13-30(14-12-29)20-8-10-26-23(16-20)28-24-27-17-22(31-24)19-7-9-25-21(15-19)18-5-3-2-4-6-18/h2-10,15-17H,11-14H2,1H3,(H,26,27,28)
InChIKeyZWTFHDFWLJMJBQ-UHFFFAOYSA-N
MW428.57 g/mol
LogP4.76
Rot. Bonds5

About N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine

N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine (PubChem CID 24831962) has the molecular formula C24H24N6S and a molecular weight of 428.57 g/mol. Its IUPAC name is N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine
PubChem CID24831962
Molecular FormulaC24H24N6S
Molecular Weight428.57 g/mol
Exact Mass428.18
IUPAC NameN-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine
SMILESCN1CCN(c2ccnc(Nc3ncc(-c4ccnc(-c5ccccc5)c4)s3)c2)CC1
InChIInChI=1S/C24H24N6S/c1-29-11-13-30(14-12-29)20-8-10-26-23(16-20)28-24-27-17-22(31-24)19-7-9-25-21(15-19)18-5-3-2-4-6-18/h2-10,15-17H,11-14H2,1H3,(H,26,27,28)
InChIKeyZWTFHDFWLJMJBQ-UHFFFAOYSA-N
XLogP4.76
TPSA57.18 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.57
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine with MolForge

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Related Compounds

N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-quinolin-4-yl-1,3-thiazol-2-amine
CID 24831466
2-[4-[2-[[4-(4-methylpiperazin-1-yl)-2-pyridinyl]amino]-1,3-thiazol-5-yl]phenyl]acetonitrile
CID 24831621
5-(2-methylpyrimidin-5-yl)-N-(4-piperazin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine
CID 15979137
5-(6-methyl-3-pyridinyl)-N-(4-morpholin-4-yl-2-pyridinyl)-1,3-thiazol-2-amine
CID 15979013
N-[4-[4-(3-morpholin-4-ylpropyl)piperazin-1-yl]-2-pyridinyl]-5-pyridin-4-yl-1,3-thiazol-2-amine
CID 24829522
1-methyl-4-[2-(3-phenylphenyl)-4-pyridinyl]piperazine
CID 25218278
N,N-dimethyl-4-[2-[(5-pyrimidin-5-yl-1,3-thiazol-2-yl)amino]-4-pyridinyl]piperazine-1-sulfonamide
CID 15979014
5-[5-(1-methylpyrazol-4-yl)-3-pyridinyl]-N-(4-piperazin-1-yl-2-pyridinyl)-1,3-thiazol-2-amine
CID 15979519
5-methyl-N-(4-phenyl-2-pyridinyl)-1,3-thiazol-2-amine
CID 172821030
5-pyridin-4-yl-N-[4-[4-(3,3,3-trifluoropropyl)piperazin-1-yl]-2-pyridinyl]-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 87944732
N-[4-(4-methylsulfinylpiperazin-1-yl)-2-pyridinyl]-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 134422625
N,N-dimethyl-3-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]aniline
CID 25216821

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine?
The IUPAC name of N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine (CID 24831962) is N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine is CN1CCN(c2ccnc(Nc3ncc(-c4ccnc(-c5ccccc5)c4)s3)c2)CC1.
What is the InChIKey of N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine?
The InChIKey is ZWTFHDFWLJMJBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N6S/c1-29-11-13-30(14-12-29)20-8-10-26-23(16-20)28-24-27-17-22(31-24)19-7-9-25-21(15-19)18-5-3-2-4-6-18/h2-10,15-17H,11-14H2,1H3,(H,26,27,28).
What are the key properties of N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine?
N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine has a molecular weight of 428.57 g/mol, XLogP of 4.76, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]-5-(2-phenyl-4-pyridinyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 24831962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).