N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine

C13H19N3S — CID 35474995

IUPACN,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
SMILESCCN(CC)c1nc(C)nc2sc(C)c(C)c12
InChIInChI=1S/C13H19N3S/c1-6-16(7-2)12-11-8(3)9(4)17-13(11)15-10(5)14-12/h6-7H2,1-5H3
InChIKeyQYQNLJQKQZPZTI-UHFFFAOYSA-N
MW249.38 g/mol
LogP3.46
Rot. Bonds3

About N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine

N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 35474995) has the molecular formula C13H19N3S and a molecular weight of 249.38 g/mol. Its IUPAC name is N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
PubChem CID35474995
Molecular FormulaC13H19N3S
Molecular Weight249.38 g/mol
Exact Mass249.13
IUPAC NameN,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
SMILESCCN(CC)c1nc(C)nc2sc(C)c(C)c12
InChIInChI=1S/C13H19N3S/c1-6-16(7-2)12-11-8(3)9(4)17-13(11)15-10(5)14-12/h6-7H2,1-5H3
InChIKeyQYQNLJQKQZPZTI-UHFFFAOYSA-N
XLogP3.46
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine (CID 35474995) is N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine is CCN(CC)c1nc(C)nc2sc(C)c(C)c12.
What is the InChIKey of N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is QYQNLJQKQZPZTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3S/c1-6-16(7-2)12-11-8(3)9(4)17-13(11)15-10(5)14-12/h6-7H2,1-5H3.
What are the key properties of N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 249.38 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 35474995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).