2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine

C14H20N4OS2 — CID 64534932

IUPAC2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine
SMILESCC(C)N1CCOC(CSc2nc(N)c3ccsc3n2)C1
InChIInChI=1S/C14H20N4OS2/c1-9(2)18-4-5-19-10(7-18)8-21-14-16-12(15)11-3-6-20-13(11)17-14/h3,6,9-10H,4-5,7-8H2,1-2H3,(H2,15,16,17)
InChIKeyHJZZFHBOLQAKTJ-UHFFFAOYSA-N
MW324.48 g/mol
LogP2.47
Rot. Bonds4

About 2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine

2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine (PubChem CID 64534932) has the molecular formula C14H20N4OS2 and a molecular weight of 324.48 g/mol. Its IUPAC name is 2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine
PubChem CID64534932
Molecular FormulaC14H20N4OS2
Molecular Weight324.48 g/mol
Exact Mass324.11
IUPAC Name2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine
SMILESCC(C)N1CCOC(CSc2nc(N)c3ccsc3n2)C1
InChIInChI=1S/C14H20N4OS2/c1-9(2)18-4-5-19-10(7-18)8-21-14-16-12(15)11-3-6-20-13(11)17-14/h3,6,9-10H,4-5,7-8H2,1-2H3,(H2,15,16,17)
InChIKeyHJZZFHBOLQAKTJ-UHFFFAOYSA-N
XLogP2.47
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.48
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine with MolForge

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Related Compounds

2-methyl-6-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]aniline
CID 79146733
4-propan-2-yl-5-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]-1,2,4-triazol-3-amine
CID 64534933
2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]-1,3-benzothiazol-6-amine
CID 64532760
2-[(3-bromothiophen-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine
CID 55111023
2-[(5-bromofuran-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine
CID 62728609
2-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine
CID 37178860
4-methyl-1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrazol-3-amine
CID 64535535
3-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]benzoic acid
CID 64535093
4-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]butan-2-amine
CID 66233245
2-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-methoxyethyl)acetamide
CID 60699011
2-[(6-bromo-3-pyridinyl)oxymethyl]-4-propan-2-ylmorpholine
CID 107396660
ethyl 5-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]-1,3,4-oxadiazole-2-carboxylate
CID 116700034

Frequently Asked Questions

What is the IUPAC name of 2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine (CID 64534932) is 2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine is CC(C)N1CCOC(CSc2nc(N)c3ccsc3n2)C1.
What is the InChIKey of 2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is HJZZFHBOLQAKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4OS2/c1-9(2)18-4-5-19-10(7-18)8-21-14-16-12(15)11-3-6-20-13(11)17-14/h3,6,9-10H,4-5,7-8H2,1-2H3,(H2,15,16,17).
What are the key properties of 2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine?
2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 324.48 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-propan-2-ylmorpholin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 64534932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).