4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine

C14H21N3O2S — CID 103332606

IUPAC4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine
SMILESCCCNc1nc(OC(C)COC)c2cc(C)sc2n1
InChIInChI=1S/C14H21N3O2S/c1-5-6-15-14-16-12(19-9(2)8-18-4)11-7-10(3)20-13(11)17-14/h7,9H,5-6,8H2,1-4H3,(H,15,16,17)
InChIKeyKURYIPHCWVSMGS-UHFFFAOYSA-N
MW295.41 g/mol
LogP3.24
Rot. Bonds7

About 4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine

4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103332606) has the molecular formula C14H21N3O2S and a molecular weight of 295.41 g/mol. Its IUPAC name is 4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103332606
Molecular FormulaC14H21N3O2S
Molecular Weight295.41 g/mol
Exact Mass295.14
IUPAC Name4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine
SMILESCCCNc1nc(OC(C)COC)c2cc(C)sc2n1
InChIInChI=1S/C14H21N3O2S/c1-5-6-15-14-16-12(19-9(2)8-18-4)11-7-10(3)20-13(11)17-14/h7,9H,5-6,8H2,1-4H3,(H,15,16,17)
InChIKeyKURYIPHCWVSMGS-UHFFFAOYSA-N
XLogP3.24
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[4-(1-methoxypropan-2-yloxy)-6-methylthieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336311
4-but-3-yn-2-yloxy-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 106795340
4-N-(1-methoxypropan-2-yl)-6-methyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324235
4-hexoxy-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 103331315
N-ethyl-6-methyl-4-propan-2-yloxythieno[2,3-d]pyrimidin-2-amine
CID 103331498
4-chloro-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 82309354
6-methyl-4-N-(3-methylbutan-2-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103323240
6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 103332717
4-N-(2-ethoxyethyl)-6-methyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325198
2-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
CID 103324859
2-N-ethyl-4-N-(1-methoxypropan-2-yl)-4-N,6-dimethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325816
2-chloro-6-methyl-4-pentan-2-yloxythieno[2,3-d]pyrimidine
CID 103320276

Frequently Asked Questions

What is the IUPAC name of 4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine (CID 103332606) is 4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine is CCCNc1nc(OC(C)COC)c2cc(C)sc2n1.
What is the InChIKey of 4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is KURYIPHCWVSMGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2S/c1-5-6-15-14-16-12(19-9(2)8-18-4)11-7-10(3)20-13(11)17-14/h7,9H,5-6,8H2,1-4H3,(H,15,16,17).
What are the key properties of 4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine?
4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 295.41 g/mol, XLogP of 3.24, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103332606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).