N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine

C14H15N5S — CID 62189376

IUPACN-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCCNc1nc(-c2cnccn2)nc2sc(C)c(C)c12
InChIInChI=1S/C14H15N5S/c1-4-16-13-11-8(2)9(3)20-14(11)19-12(18-13)10-7-15-5-6-17-10/h5-7H,4H2,1-3H3,(H,16,18,19)
InChIKeyZWXPEJWMCUIXPU-UHFFFAOYSA-N
MW285.38 g/mol
LogP3.20
Rot. Bonds3

About N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine

N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 62189376) has the molecular formula C14H15N5S and a molecular weight of 285.38 g/mol. Its IUPAC name is N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine
PubChem CID62189376
Molecular FormulaC14H15N5S
Molecular Weight285.38 g/mol
Exact Mass285.10
IUPAC NameN-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCCNc1nc(-c2cnccn2)nc2sc(C)c(C)c12
InChIInChI=1S/C14H15N5S/c1-4-16-13-11-8(2)9(3)20-14(11)19-12(18-13)10-7-15-5-6-17-10/h5-7H,4H2,1-3H3,(H,16,18,19)
InChIKeyZWXPEJWMCUIXPU-UHFFFAOYSA-N
XLogP3.20
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.38
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine (CID 62189376) is N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine is CCNc1nc(-c2cnccn2)nc2sc(C)c(C)c12.
What is the InChIKey of N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is ZWXPEJWMCUIXPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5S/c1-4-16-13-11-8(2)9(3)20-14(11)19-12(18-13)10-7-15-5-6-17-10/h5-7H,4H2,1-3H3,(H,16,18,19).
What are the key properties of N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine?
N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 285.38 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5,6-dimethyl-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 62189376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).