[4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol

C15H16N6O2S — CID 59829582

IUPAC[4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol
SMILESNc1ncc(-c2nc(N3CCOC(CO)C3)c3ccsc3n2)cn1
InChIInChI=1S/C15H16N6O2S/c16-15-17-5-9(6-18-15)12-19-13(11-1-4-24-14(11)20-12)21-2-3-23-10(7-21)8-22/h1,4-6,10,22H,2-3,7-8H2,(H2,16,17,18)
InChIKeyDVNRBGDTSMVCGG-UHFFFAOYSA-N
MW344.40 g/mol
LogP0.93
Rot. Bonds3

About [4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol

[4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol (PubChem CID 59829582) has the molecular formula C15H16N6O2S and a molecular weight of 344.40 g/mol. Its IUPAC name is [4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol
PubChem CID59829582
Molecular FormulaC15H16N6O2S
Molecular Weight344.40 g/mol
Exact Mass344.11
IUPAC Name[4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol
SMILESNc1ncc(-c2nc(N3CCOC(CO)C3)c3ccsc3n2)cn1
InChIInChI=1S/C15H16N6O2S/c16-15-17-5-9(6-18-15)12-19-13(11-1-4-24-14(11)20-12)21-2-3-23-10(7-21)8-22/h1,4-6,10,22H,2-3,7-8H2,(H2,16,17,18)
InChIKeyDVNRBGDTSMVCGG-UHFFFAOYSA-N
XLogP0.93
TPSA110.28 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.40
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Related Compounds

N-[[4-[2-(2-aminopyrimidin-5-yl)thieno[3,2-d]pyrimidin-4-yl]morpholin-2-yl]methyl]benzamide
CID 59829363
4-(2-ethylmorpholin-4-yl)-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103325050
[4-(2,6-diaminopyrimidin-4-yl)morpholin-2-yl]methanol
CID 81217236
[4-(3-methylquinoxalin-2-yl)morpholin-2-yl]methanol
CID 79839156
5-(5-methyl-4-morpholin-4-ylthieno[2,3-d]pyrimidin-2-yl)pyrimidin-2-amine
CID 59829304
(4-thieno[3,2-c]pyridin-4-ylmorpholin-2-yl)methanamine
CID 61338182
N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103323885
5-(6-methyl-4-morpholin-4-ylthieno[2,3-d]pyrimidin-2-yl)pyrimidin-2-amine
CID 59829563
[4-(6-amino-2-phenylpyrimidin-4-yl)morpholin-2-yl]methanol
CID 115915735
N-methyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103323884
(2S)-2-[(4-methylpyrazol-1-yl)methyl]-4-thieno[2,3-d]pyrimidin-4-ylmorpholine
CID 95337729
[(2S)-4-(3-amino-4-fluorophenyl)morpholin-2-yl]methanol
CID 162439692

Frequently Asked Questions

What is the IUPAC name of [4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol?
The IUPAC name of [4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol (CID 59829582) is [4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol is Nc1ncc(-c2nc(N3CCOC(CO)C3)c3ccsc3n2)cn1.
What is the InChIKey of [4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol?
The InChIKey is DVNRBGDTSMVCGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O2S/c16-15-17-5-9(6-18-15)12-19-13(11-1-4-24-14(11)20-12)21-2-3-23-10(7-21)8-22/h1,4-6,10,22H,2-3,7-8H2,(H2,16,17,18).
What are the key properties of [4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol?
[4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol has a molecular weight of 344.40 g/mol, XLogP of 0.93, 3 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(2-aminopyrimidin-5-yl)thieno[2,3-d]pyrimidin-4-yl]morpholin-2-yl]methanol is sourced from PubChem (CID 59829582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).