4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine

C17H19N3O2S — CID 141266148

IUPAC4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine
SMILESCCc1ccc(-c2ncc3cc(CN4CCOCC4)sc3n2)o1
InChIInChI=1S/C17H19N3O2S/c1-2-13-3-4-15(22-13)16-18-10-12-9-14(23-17(12)19-16)11-20-5-7-21-8-6-20/h3-4,9-10H,2,5-8,11H2,1H3
InChIKeyGJEVUQYWUUNKDD-UHFFFAOYSA-N
MW329.43 g/mol
LogP3.35
Rot. Bonds4

About 4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine

4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine (PubChem CID 141266148) has the molecular formula C17H19N3O2S and a molecular weight of 329.43 g/mol. Its IUPAC name is 4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine
PubChem CID141266148
Molecular FormulaC17H19N3O2S
Molecular Weight329.43 g/mol
Exact Mass329.12
IUPAC Name4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine
SMILESCCc1ccc(-c2ncc3cc(CN4CCOCC4)sc3n2)o1
InChIInChI=1S/C17H19N3O2S/c1-2-13-3-4-15(22-13)16-18-10-12-9-14(23-17(12)19-16)11-20-5-7-21-8-6-20/h3-4,9-10H,2,5-8,11H2,1H3
InChIKeyGJEVUQYWUUNKDD-UHFFFAOYSA-N
XLogP3.35
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.43
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(5-cyclopropylfuran-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine;ethane
CID 143976397
6-[(2,6-dimethylpiperidin-1-yl)methyl]-2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 67356556
4-[(5-quinazolin-6-ylfuran-2-yl)methyl]morpholine
CID 141290610
4-[(5-methyl-1-benzothiophen-2-yl)methyl]morpholine
CID 117185317
4-[[5-(3,4-dichlorophenyl)furan-2-yl]methyl]morpholine
CID 142747429
4-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]morpholine
CID 155546801
2-(5-ethylfuran-2-yl)-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 106716043
4-[(6-chloro-1-benzothiophen-2-yl)methyl]morpholine
CID 117179758
2-(3-methoxyphenyl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 45278785
4-[(7-bromo-1-benzothiophen-2-yl)methyl]morpholine
CID 117183219
4-(1,4-oxazepan-4-ylmethyl)-N-propylpyridin-2-amine
CID 55139785
N-methyl-2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine
CID 158263053

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine?
The IUPAC name of 4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine (CID 141266148) is 4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine.
What is the SMILES notation for 4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine?
The canonical SMILES for 4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine is CCc1ccc(-c2ncc3cc(CN4CCOCC4)sc3n2)o1.
What is the InChIKey of 4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine?
The InChIKey is GJEVUQYWUUNKDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2S/c1-2-13-3-4-15(22-13)16-18-10-12-9-14(23-17(12)19-16)11-20-5-7-21-8-6-20/h3-4,9-10H,2,5-8,11H2,1H3.
What are the key properties of 4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine?
4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine has a molecular weight of 329.43 g/mol, XLogP of 3.35, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(5-ethylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]methyl]morpholine is sourced from PubChem (CID 141266148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).