2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine

C15H15N3OS — CID 61025887

IUPAC2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCCOc1cccc(-c2nc(N)c3cc(C)sc3n2)c1
InChIInChI=1S/C15H15N3OS/c1-3-19-11-6-4-5-10(8-11)14-17-13(16)12-7-9(2)20-15(12)18-14/h4-8H,3H2,1-2H3,(H2,16,17,18)
InChIKeyDEEKERIXRQFWAK-UHFFFAOYSA-N
MW285.37 g/mol
LogP3.65
Rot. Bonds3

About 2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine

2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 61025887) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is 2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
PubChem CID61025887
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC Name2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCCOc1cccc(-c2nc(N)c3cc(C)sc3n2)c1
InChIInChI=1S/C15H15N3OS/c1-3-19-11-6-4-5-10(8-11)14-17-13(16)12-7-9(2)20-15(12)18-14/h4-8H,3H2,1-2H3,(H2,16,17,18)
InChIKeyDEEKERIXRQFWAK-UHFFFAOYSA-N
XLogP3.65
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3,4-dimethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 61025255
2-(3-ethoxyphenyl)-5-iodopyrimidin-4-amine
CID 66302482
[2-(3-ethoxyphenyl)-4,6-dimethylpyrimidin-5-yl]methanamine
CID 62746307
2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine
CID 62192979
2-chloro-N-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 103321082
4-chloro-2-(3-ethoxyphenyl)-6-methylpyrimidine
CID 43557478
2-(3-methoxyphenyl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 45278785
5-iodo-6-methyl-2-(3-propoxyphenyl)pyrimidin-4-amine
CID 66296695
2-[(3-methoxyphenyl)methyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 61025987
4-amino-2-(3-ethoxyphenyl)-N-propan-2-ylpyrimidine-5-carboxamide
CID 83567312
6-ethyl-2-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 63614813
4-chloro-2-(3-ethoxyphenyl)-6-ethyl-5-methylpyrimidine
CID 55247750

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine (CID 61025887) is 2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine is CCOc1cccc(-c2nc(N)c3cc(C)sc3n2)c1.
What is the InChIKey of 2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is DEEKERIXRQFWAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-3-19-11-6-4-5-10(8-11)14-17-13(16)12-7-9(2)20-15(12)18-14/h4-8H,3H2,1-2H3,(H2,16,17,18).
What are the key properties of 2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine?
2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 285.37 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 61025887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).