6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine

C15H17N5O2S — CID 129004575

IUPAC6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine
SMILESCc1noc([C@@H]2CC[C@H](CNc3ncnc4sc(C)cc34)O2)n1
InChIInChI=1S/C15H17N5O2S/c1-8-5-11-13(17-7-18-15(11)23-8)16-6-10-3-4-12(21-10)14-19-9(2)20-22-14/h5,7,10,12H,3-4,6H2,1-2H3,(H,16,17,18)/t10-,12+/m1/s1
InChIKeyUTAXGMONGGMXKN-PWSUYJOCSA-N
MW331.40 g/mol
LogP3.02
Rot. Bonds4

About 6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine

6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine (PubChem CID 129004575) has the molecular formula C15H17N5O2S and a molecular weight of 331.40 g/mol. Its IUPAC name is 6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine
PubChem CID129004575
Molecular FormulaC15H17N5O2S
Molecular Weight331.40 g/mol
Exact Mass331.11
IUPAC Name6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine
SMILESCc1noc([C@@H]2CC[C@H](CNc3ncnc4sc(C)cc34)O2)n1
InChIInChI=1S/C15H17N5O2S/c1-8-5-11-13(17-7-18-15(11)23-8)16-6-10-3-4-12(21-10)14-19-9(2)20-22-14/h5,7,10,12H,3-4,6H2,1-2H3,(H,16,17,18)/t10-,12+/m1/s1
InChIKeyUTAXGMONGGMXKN-PWSUYJOCSA-N
XLogP3.02
TPSA85.96 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.40
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]quinazolin-4-amine
CID 128968332
5-chloro-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-2-amine
CID 129004564
6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]-2-propan-2-ylpyrimidin-4-amine
CID 128973858
N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 129004563
2-(methoxymethyl)-6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyrimidin-4-amine
CID 128973864
3-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]-[1,2]oxazolo[5,4-b]pyridine-5-sulfonamide
CID 128965596
3-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-N-(oxolan-2-ylmethyl)propanamide
CID 52985519
(3S)-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thiolan-3-amine
CID 129330675
2-amino-5-chloro-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]pyridine-3-sulfonamide
CID 129004123
(3R,5R)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(6-methylthieno[2,3-d]pyrimidin-4-yl)pyrrolidin-3-ol
CID 129004207
6-methyl-N-[[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]thieno[2,3-d]pyrimidin-4-amine
CID 129333678
6-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4-amine
CID 133409514

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine (CID 129004575) is 6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine is Cc1noc([C@@H]2CC[C@H](CNc3ncnc4sc(C)cc34)O2)n1.
What is the InChIKey of 6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is UTAXGMONGGMXKN-PWSUYJOCSA-N. The full InChI is InChI=1S/C15H17N5O2S/c1-8-5-11-13(17-7-18-15(11)23-8)16-6-10-3-4-12(21-10)14-19-9(2)20-22-14/h5,7,10,12H,3-4,6H2,1-2H3,(H,16,17,18)/t10-,12+/m1/s1.
What are the key properties of 6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine?
6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 331.40 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[[(2R,5S)-5-(3-methyl-1,2,4-oxadiazol-5-yl)oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 129004575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).