4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine

C14H22N4OS — CID 103326280

IUPAC4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine
SMILESCOCCN(CC(C)C)c1nc(N)nc2sc(C)cc12
InChIInChI=1S/C14H22N4OS/c1-9(2)8-18(5-6-19-4)12-11-7-10(3)20-13(11)17-14(15)16-12/h7,9H,5-6,8H2,1-4H3,(H2,15,16,17)
InChIKeyANKROIHKCXOHTM-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.69
Rot. Bonds6

About 4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine

4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine (PubChem CID 103326280) has the molecular formula C14H22N4OS and a molecular weight of 294.42 g/mol. Its IUPAC name is 4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine
PubChem CID103326280
Molecular FormulaC14H22N4OS
Molecular Weight294.42 g/mol
Exact Mass294.15
IUPAC Name4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine
SMILESCOCCN(CC(C)C)c1nc(N)nc2sc(C)cc12
InChIInChI=1S/C14H22N4OS/c1-9(2)8-18(5-6-19-4)12-11-7-10(3)20-13(11)17-14(15)16-12/h7,9H,5-6,8H2,1-4H3,(H2,15,16,17)
InChIKeyANKROIHKCXOHTM-UHFFFAOYSA-N
XLogP2.69
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine (CID 103326280) is 4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine is COCCN(CC(C)C)c1nc(N)nc2sc(C)cc12.
What is the InChIKey of 4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is ANKROIHKCXOHTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4OS/c1-9(2)8-18(5-6-19-4)12-11-7-10(3)20-13(11)17-14(15)16-12/h7,9H,5-6,8H2,1-4H3,(H2,15,16,17).
What are the key properties of 4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine?
4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 294.42 g/mol, XLogP of 2.69, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-methoxyethyl)-6-methyl-4-N-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 103326280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).