N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine

C15H15N3OS — CID 103331842

IUPACN-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine
SMILESCCNc1nc(Oc2ccccc2C)c2ccsc2n1
InChIInChI=1S/C15H15N3OS/c1-3-16-15-17-13(11-8-9-20-14(11)18-15)19-12-7-5-4-6-10(12)2/h4-9H,3H2,1-2H3,(H,16,17,18)
InChIKeyJXEGYFGVQPZKCF-UHFFFAOYSA-N
MW285.37 g/mol
LogP4.22
Rot. Bonds4

About N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine

N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine (PubChem CID 103331842) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine
PubChem CID103331842
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC NameN-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine
SMILESCCNc1nc(Oc2ccccc2C)c2ccsc2n1
InChIInChI=1S/C15H15N3OS/c1-3-16-15-17-13(11-8-9-20-14(11)18-15)19-12-7-5-4-6-10(12)2/h4-9H,3H2,1-2H3,(H,16,17,18)
InChIKeyJXEGYFGVQPZKCF-UHFFFAOYSA-N
XLogP4.22
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-methylphenoxy)-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 103331849
N-ethyl-4-(2-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103332005
4-(2,5-dimethylphenoxy)-N-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103331816
4-(5-bromo-2-methylphenoxy)-N-ethylthieno[2,3-d]pyrimidin-2-amine
CID 107287415
N-ethyl-4-phenylmethoxythieno[2,3-d]pyrimidin-2-amine
CID 103331360
4-(3,5-difluorophenoxy)-N-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103332454
N-ethyl-4-[(5-methyl-1H-pyrazol-3-yl)oxy]thieno[2,3-d]pyrimidin-2-amine
CID 103333102
N-ethyl-4-(3-fluorophenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331903
N-ethyl-4-(1-methylpyrazol-4-yl)oxythieno[2,3-d]pyrimidin-2-amine
CID 103333500
4-(3-bromo-4-fluorophenoxy)-N-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103333352
N-ethyl-4-pentoxythieno[2,3-d]pyrimidin-2-amine
CID 103331646
5-chloro-N-ethyl-4-(2-methylphenoxy)pyrimidin-2-amine
CID 80869054

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine (CID 103331842) is N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine is CCNc1nc(Oc2ccccc2C)c2ccsc2n1.
What is the InChIKey of N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine?
The InChIKey is JXEGYFGVQPZKCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-3-16-15-17-13(11-8-9-20-14(11)18-15)19-12-7-5-4-6-10(12)2/h4-9H,3H2,1-2H3,(H,16,17,18).
What are the key properties of N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine?
N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine has a molecular weight of 285.37 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103331842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).