7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine

C11H10N4OS — CID 106419173

IUPAC7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NCc3ccno3)ncnc12
InChIInChI=1S/C11H10N4OS/c1-7-5-17-10-9(7)13-6-14-11(10)12-4-8-2-3-15-16-8/h2-3,5-6H,4H2,1H3,(H,12,13,14)
InChIKeyAXLOBINYTBKNLU-UHFFFAOYSA-N
MW246.30 g/mol
LogP2.60
Rot. Bonds3

About 7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine

7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine (PubChem CID 106419173) has the molecular formula C11H10N4OS and a molecular weight of 246.30 g/mol. Its IUPAC name is 7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine
PubChem CID106419173
Molecular FormulaC11H10N4OS
Molecular Weight246.30 g/mol
Exact Mass246.06
IUPAC Name7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NCc3ccno3)ncnc12
InChIInChI=1S/C11H10N4OS/c1-7-5-17-10-9(7)13-6-14-11(10)12-4-8-2-3-15-16-8/h2-3,5-6H,4H2,1H3,(H,12,13,14)
InChIKeyAXLOBINYTBKNLU-UHFFFAOYSA-N
XLogP2.60
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.30
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine
CID 102686243
2-[[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]methyl]phenol
CID 102686720
N-[(4-chlorophenyl)methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686195
N-[[2-(aminomethyl)phenyl]methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686834
N-[(3-ethyl-2-pyridinyl)methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686617
2-methyl-5-[[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]methyl]furan-3-carboxylic acid
CID 102685941
6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)pyrimidin-4-amine
CID 106424788
1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine
CID 102686862
N'-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
CID 102686176
N-but-3-enyl-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686671
N,2-dimethyl-N'-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
CID 102686940
4-[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]butan-1-ol
CID 106842572

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of 7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine (CID 106419173) is 7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine is Cc1csc2c(NCc3ccno3)ncnc12.
What is the InChIKey of 7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine?
The InChIKey is AXLOBINYTBKNLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4OS/c1-7-5-17-10-9(7)13-6-14-11(10)12-4-8-2-3-15-16-8/h2-3,5-6H,4H2,1H3,(H,12,13,14).
What are the key properties of 7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine?
7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine has a molecular weight of 246.30 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 106419173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).