N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine

C13H19N3S — CID 6458235

IUPACN,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cc2c(N(CC)CC)nc(C)nc2s1
InChIInChI=1S/C13H19N3S/c1-5-10-8-11-12(16(6-2)7-3)14-9(4)15-13(11)17-10/h8H,5-7H2,1-4H3
InChIKeySMSGTHONVNZXPE-UHFFFAOYSA-N
MW249.38 g/mol
LogP3.41
Rot. Bonds4

About N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine

N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 6458235) has the molecular formula C13H19N3S and a molecular weight of 249.38 g/mol. Its IUPAC name is N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine
PubChem CID6458235
Molecular FormulaC13H19N3S
Molecular Weight249.38 g/mol
Exact Mass249.13
IUPAC NameN,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cc2c(N(CC)CC)nc(C)nc2s1
InChIInChI=1S/C13H19N3S/c1-5-10-8-11-12(16(6-2)7-3)14-9(4)15-13(11)17-10/h8H,5-7H2,1-4H3
InChIKeySMSGTHONVNZXPE-UHFFFAOYSA-N
XLogP3.41
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine (CID 6458235) is N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine is CCc1cc2c(N(CC)CC)nc(C)nc2s1.
What is the InChIKey of N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is SMSGTHONVNZXPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3S/c1-5-10-8-11-12(16(6-2)7-3)14-9(4)15-13(11)17-10/h8H,5-7H2,1-4H3.
What are the key properties of N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine?
N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 249.38 g/mol, XLogP of 3.41, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,6-triethyl-2-methylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 6458235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).