N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide

C13H17N3O3S — CID 102685858

IUPACN-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide
SMILESCOCC(C)NC(=O)Cn1cnc2c(C)csc2c1=O
InChIInChI=1S/C13H17N3O3S/c1-8-6-20-12-11(8)14-7-16(13(12)18)4-10(17)15-9(2)5-19-3/h6-7,9H,4-5H2,1-3H3,(H,15,17)
InChIKeyKDRLOOQISIAHIU-UHFFFAOYSA-N
MW295.36 g/mol
LogP0.92
Rot. Bonds5

About N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide

N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide (PubChem CID 102685858) has the molecular formula C13H17N3O3S and a molecular weight of 295.36 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide
PubChem CID102685858
Molecular FormulaC13H17N3O3S
Molecular Weight295.36 g/mol
Exact Mass295.10
IUPAC NameN-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide
SMILESCOCC(C)NC(=O)Cn1cnc2c(C)csc2c1=O
InChIInChI=1S/C13H17N3O3S/c1-8-6-20-12-11(8)14-7-16(13(12)18)4-10(17)15-9(2)5-19-3/h6-7,9H,4-5H2,1-3H3,(H,15,17)
InChIKeyKDRLOOQISIAHIU-UHFFFAOYSA-N
XLogP0.92
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide 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

N-(1-methoxypropan-2-yl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 17397674
7-methyl-3-(3-methyl-2-oxobutyl)thieno[3,2-d]pyrimidin-4-one
CID 102685394
N-[(2S)-1-methoxypropan-2-yl]-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 40898847
2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 102685784
N-[(2S)-1-methoxypropan-2-yl]-2-[5-(5-methylthiophen-2-yl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetamide
CID 7646454
7-methyl-3-(2-methylpropyl)thieno[3,2-d]pyrimidin-4-one
CID 102685602
N-(4-methylcyclohexyl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide
CID 146130124
2-(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-N-(1-methoxypropan-2-yl)acetamide
CID 18203087
3-[2-(4-bromophenyl)-2-oxoethyl]-7-methylthieno[3,2-d]pyrimidin-4-one
CID 102685418
3-(3-bromo-2-methylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-one
CID 102685349
N-cyclopropyl-N-methyl-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide
CID 102685631
3-(4-chlorobutyl)-7-methylthieno[3,2-d]pyrimidin-4-one
CID 102685321

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide (CID 102685858) is N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide is COCC(C)NC(=O)Cn1cnc2c(C)csc2c1=O.
What is the InChIKey of N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide?
The InChIKey is KDRLOOQISIAHIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3S/c1-8-6-20-12-11(8)14-7-16(13(12)18)4-10(17)15-9(2)5-19-3/h6-7,9H,4-5H2,1-3H3,(H,15,17).
What are the key properties of N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide?
N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide has a molecular weight of 295.36 g/mol, XLogP of 0.92, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-2-(7-methyl-4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide is sourced from PubChem (CID 102685858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).