N,N-diethylthieno[2,3-d]pyrimidin-4-amine

C10H13N3S — CID 2808589

IUPACN,N-diethylthieno[2,3-d]pyrimidin-4-amine
SMILESCCN(CC)c1ncnc2sccc12
InChIInChI=1S/C10H13N3S/c1-3-13(4-2)9-8-5-6-14-10(8)12-7-11-9/h5-7H,3-4H2,1-2H3
InChIKeyTUFDCUHPGXLDSJ-UHFFFAOYSA-N
MW207.30 g/mol
LogP2.54
Rot. Bonds3

About N,N-diethylthieno[2,3-d]pyrimidin-4-amine

N,N-diethylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 2808589) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is N,N-diethylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,N-diethylthieno[2,3-d]pyrimidin-4-amine
PubChem CID2808589
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC NameN,N-diethylthieno[2,3-d]pyrimidin-4-amine
SMILESCCN(CC)c1ncnc2sccc12
InChIInChI=1S/C10H13N3S/c1-3-13(4-2)9-8-5-6-14-10(8)12-7-11-9/h5-7H,3-4H2,1-2H3
InChIKeyTUFDCUHPGXLDSJ-UHFFFAOYSA-N
XLogP2.54
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-diethylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N,N-diethylthieno[2,3-d]pyrimidin-4-amine (CID 2808589) is N,N-diethylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N,N-diethylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N,N-diethylthieno[2,3-d]pyrimidin-4-amine is CCN(CC)c1ncnc2sccc12.
What is the InChIKey of N,N-diethylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is TUFDCUHPGXLDSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c1-3-13(4-2)9-8-5-6-14-10(8)12-7-11-9/h5-7H,3-4H2,1-2H3.
What are the key properties of N,N-diethylthieno[2,3-d]pyrimidin-4-amine?
N,N-diethylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 207.30 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 2808589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).