4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine

C20H23N5S — CID 89423092

IUPAC4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine
SMILESCc1cccc(Nc2nc(-c3ccc(N4CCN(C)CC4)cc3)cs2)n1
InChIInChI=1S/C20H23N5S/c1-15-4-3-5-19(21-15)23-20-22-18(14-26-20)16-6-8-17(9-7-16)25-12-10-24(2)11-13-25/h3-9,14H,10-13H2,1-2H3,(H,21,22,23)
InChIKeyADAQJNLGIRKJND-UHFFFAOYSA-N
MW365.51 g/mol
LogP4.01
Rot. Bonds4

About 4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine

4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine (PubChem CID 89423092) has the molecular formula C20H23N5S and a molecular weight of 365.51 g/mol. Its IUPAC name is 4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine
PubChem CID89423092
Molecular FormulaC20H23N5S
Molecular Weight365.51 g/mol
Exact Mass365.17
IUPAC Name4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine
SMILESCc1cccc(Nc2nc(-c3ccc(N4CCN(C)CC4)cc3)cs2)n1
InChIInChI=1S/C20H23N5S/c1-15-4-3-5-19(21-15)23-20-22-18(14-26-20)16-6-8-17(9-7-16)25-12-10-24(2)11-13-25/h3-9,14H,10-13H2,1-2H3,(H,21,22,23)
InChIKeyADAQJNLGIRKJND-UHFFFAOYSA-N
XLogP4.01
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.51
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine with MolForge

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Related Compounds

Stf-62247
CID 704473
(4-Phenyl-thiazol-2-yl)-pyridin-2-yl-amine
CID 750531
Acetamide, N-[4-[2-(2-pyridinylamino)-4-thiazolyl]phenyl]-
CID 973066
N-(2-ethylphenyl)-4-(pyridin-3-yl)-1,3-thiazol-2-amine
CID 746667
(3-Methyl-pyridin-2-yl)-(4-pyridin-2-yl-thiazol-2-yl)-amine
CID 972880
N-(6-methylpyridin-2-yl)-5-phenyl-1,3-thiazol-2-amine
CID 5329394
4-(4-Fluorophenyl)-2-(1-methylpiperidin-4-yl)-5-(2-(1-(S)-Phenylethyl)amino-4-pyridinyl)thiazole
CID 10390073
4-phenyl-N-(3-pyridinyl)-2-thiazolamine
CID 697807
(5-Methyl-pyridin-2-yl)-(4-phenyl-thiazol-2-yl)-amine
CID 972993
(4-(4-Fluorophenyl)(2,5-thiazolyl))-2-pyridylamine
CID 1092430
N,N-diethyl-N'-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzene-1,4-diamine
CID 1502838
N-(4-methylpyridin-2-yl)-4-(pyridin-2-yl)thiazol-2-amine
CID 704452

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine (CID 89423092) is 4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine is Cc1cccc(Nc2nc(-c3ccc(N4CCN(C)CC4)cc3)cs2)n1.
What is the InChIKey of 4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine?
The InChIKey is ADAQJNLGIRKJND-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5S/c1-15-4-3-5-19(21-15)23-20-22-18(14-26-20)16-6-8-17(9-7-16)25-12-10-24(2)11-13-25/h3-9,14H,10-13H2,1-2H3,(H,21,22,23).
What are the key properties of 4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine?
4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine has a molecular weight of 365.51 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 89423092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).