4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine

C23H25ClN6OS — CID 145104287

IUPAC4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
SMILESCC1(c2ccc(Cl)cc2)CN(c2cccc(-c3csc(NC4=NCCCN4)n3)n2)CCO1
InChIInChI=1S/C23H25ClN6OS/c1-23(16-6-8-17(24)9-7-16)15-30(12-13-31-23)20-5-2-4-18(27-20)19-14-32-22(28-19)29-21-25-10-3-11-26-21/h2,4-9,14H,3,10-13,15H2,1H3,(H2,25,26,28,29)
InChIKeyIVMNXDFUSIHBPB-UHFFFAOYSA-N
MW469.01 g/mol
LogP4.37
Rot. Bonds4

About 4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine

4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine (PubChem CID 145104287) has the molecular formula C23H25ClN6OS and a molecular weight of 469.01 g/mol. Its IUPAC name is 4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
PubChem CID145104287
Molecular FormulaC23H25ClN6OS
Molecular Weight469.01 g/mol
Exact Mass468.15
IUPAC Name4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
SMILESCC1(c2ccc(Cl)cc2)CN(c2cccc(-c3csc(NC4=NCCCN4)n3)n2)CCO1
InChIInChI=1S/C23H25ClN6OS/c1-23(16-6-8-17(24)9-7-16)15-30(12-13-31-23)20-5-2-4-18(27-20)19-14-32-22(28-19)29-21-25-10-3-11-26-21/h2,4-9,14H,3,10-13,15H2,1H3,(H2,25,26,28,29)
InChIKeyIVMNXDFUSIHBPB-UHFFFAOYSA-N
XLogP4.37
TPSA74.67 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500469.01
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine with MolForge

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Related Compounds

4-[6-(2-methyl-2-phenylmorpholin-4-yl)-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
CID 145105122
4-[6-(4-methoxyiminopiperidin-1-yl)-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
CID 145105067
4-[6-(6,7-dihydro-4H-furo[3,2-c]pyridin-5-yl)-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
CID 145104925
4-[6-(4-propan-2-yloxyiminopiperidin-1-yl)-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
CID 145104207
N-(1,4,5,6-tetrahydropyrimidin-2-yl)-4-[6-[2-[4-(trifluoromethyl)phenyl]morpholin-4-yl]-2-pyridinyl]-1,3-thiazol-2-amine
CID 145104626
4-[6-(2-propan-2-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
CID 145104104
4-[6-(2,5-difluorophenyl)-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
CID 145104153
4-[2-(6-morpholin-4-yl-3-pyridinyl)-1,3-thiazol-4-yl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
CID 145104108
2-[4-[2-(1,4,5,6-tetrahydropyrimidin-2-ylamino)-1,3-thiazol-4-yl]-1,3-thiazol-2-yl]phenol
CID 145104911
4-[3-(4-chlorophenoxy)pyrazin-2-yl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
CID 145104117
4-[6-[methyl(2-phenylethyl)amino]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
CID 145104009
4-(2-chloro-4-pyridinyl)-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine
CID 145104006

Frequently Asked Questions

What is the IUPAC name of 4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine (CID 145104287) is 4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine is CC1(c2ccc(Cl)cc2)CN(c2cccc(-c3csc(NC4=NCCCN4)n3)n2)CCO1.
What is the InChIKey of 4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine?
The InChIKey is IVMNXDFUSIHBPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25ClN6OS/c1-23(16-6-8-17(24)9-7-16)15-30(12-13-31-23)20-5-2-4-18(27-20)19-14-32-22(28-19)29-21-25-10-3-11-26-21/h2,4-9,14H,3,10-13,15H2,1H3,(H2,25,26,28,29).
What are the key properties of 4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine?
4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine has a molecular weight of 469.01 g/mol, XLogP of 4.37, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[2-(4-chlorophenyl)-2-methylmorpholin-4-yl]-2-pyridinyl]-N-(1,4,5,6-tetrahydropyrimidin-2-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 145104287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).