4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine

C15H17N5S2 — CID 127896861

IUPAC4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine
SMILESCc1csc(NC2CCN(c3ncnc4sccc34)CC2)n1
InChIInChI=1S/C15H17N5S2/c1-10-8-22-15(18-10)19-11-2-5-20(6-3-11)13-12-4-7-21-14(12)17-9-16-13/h4,7-9,11H,2-3,5-6H2,1H3,(H,18,19)
InChIKeySBAPULCPZRGWAO-UHFFFAOYSA-N
MW331.47 g/mol
LogP3.54
Rot. Bonds3

About 4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine

4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine (PubChem CID 127896861) has the molecular formula C15H17N5S2 and a molecular weight of 331.47 g/mol. Its IUPAC name is 4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine
PubChem CID127896861
Molecular FormulaC15H17N5S2
Molecular Weight331.47 g/mol
Exact Mass331.09
IUPAC Name4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine
SMILESCc1csc(NC2CCN(c3ncnc4sccc34)CC2)n1
InChIInChI=1S/C15H17N5S2/c1-10-8-22-15(18-10)19-11-2-5-20(6-3-11)13-12-4-7-21-14(12)17-9-16-13/h4,7-9,11H,2-3,5-6H2,1H3,(H,18,19)
InChIKeySBAPULCPZRGWAO-UHFFFAOYSA-N
XLogP3.54
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.47
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine with MolForge

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Related Compounds

N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)pyrimidin-4-amine
CID 126887234
N-[1-(5-bromopyrimidin-2-yl)piperidin-4-yl]-4-methyl-1,3-thiazol-2-amine
CID 133481351
N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]thieno[2,3-d]pyrimidin-4-amine
CID 133336179
4-(4-pyrrol-1-ylpiperidin-1-yl)thieno[2,3-d]pyrimidine
CID 56822117
1-thieno[2,3-d]pyrimidin-4-ylpiperidine-4-carboxamide
CID 2098585
N-cyclopentyl-4-methyl-1,3-thiazol-2-amine;molecular hydrogen
CID 142956868
4-(4-pyrrolidin-2-ylpiperidin-1-yl)thieno[2,3-d]pyrimidine
CID 63256925
2-[methyl-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)amino]ethanol
CID 39817579
4-[4-(5-methoxypyrimidin-2-yl)oxypiperidin-1-yl]thieno[2,3-d]pyrimidine
CID 154581116
N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)morpholine-4-carboxamide
CID 139021545
4-[3-(chloromethyl)pyrrolidin-1-yl]thieno[2,3-d]pyrimidine
CID 63390055
4-thieno[2,3-d]pyrimidin-4-ylmorpholine
CID 2457329

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine (CID 127896861) is 4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine is Cc1csc(NC2CCN(c3ncnc4sccc34)CC2)n1.
What is the InChIKey of 4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine?
The InChIKey is SBAPULCPZRGWAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5S2/c1-10-8-22-15(18-10)19-11-2-5-20(6-3-11)13-12-4-7-21-14(12)17-9-16-13/h4,7-9,11H,2-3,5-6H2,1H3,(H,18,19).
What are the key properties of 4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine?
4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine has a molecular weight of 331.47 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 127896861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).