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

C14H19N3O2S — CID 103332717

IUPAC6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine
SMILESCCCNc1nc(OC2CCOC2)c2cc(C)sc2n1
InChIInChI=1S/C14H19N3O2S/c1-3-5-15-14-16-12(19-10-4-6-18-8-10)11-7-9(2)20-13(11)17-14/h7,10H,3-6,8H2,1-2H3,(H,15,16,17)
InChIKeyYSASEGFVPLWXFI-UHFFFAOYSA-N
MW293.39 g/mol
LogP2.99
Rot. Bonds5

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

6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103332717) has the molecular formula C14H19N3O2S and a molecular weight of 293.39 g/mol. Its IUPAC name is 6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103332717
Molecular FormulaC14H19N3O2S
Molecular Weight293.39 g/mol
Exact Mass293.12
IUPAC Name6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine
SMILESCCCNc1nc(OC2CCOC2)c2cc(C)sc2n1
InChIInChI=1S/C14H19N3O2S/c1-3-5-15-14-16-12(19-10-4-6-18-8-10)11-7-9(2)20-13(11)17-14/h7,10H,3-6,8H2,1-2H3,(H,15,16,17)
InChIKeyYSASEGFVPLWXFI-UHFFFAOYSA-N
XLogP2.99
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N,6-dimethyl-4-(oxan-4-yloxy)thieno[2,3-d]pyrimidin-2-amine
CID 103332150
4-hexoxy-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 103331315
4-N-cyclopropyl-4-N-ethyl-6-methyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324544
2-N-ethyl-4-N,6-dimethyl-4-N-(oxolan-3-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103329424
4-N-(cyclopropylmethyl)-4-N,6-dimethyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325410
4-(1-methoxypropan-2-yloxy)-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 103332606
4-but-3-yn-2-yloxy-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 106795340
6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103330123
4-chloro-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 82309354
4-(oxolan-3-yloxy)-6-propan-2-yloxy-N-propyl-1,3,5-triazin-2-amine
CID 80876739
5-fluoro-4-(oxan-4-yloxy)-N-propylpyrimidin-2-amine
CID 80872902
4-(3,5-dimethylcyclohexyl)oxy-N,6-dimethylthieno[2,3-d]pyrimidin-2-amine
CID 103332845

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine (CID 103332717) is 6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine is CCCNc1nc(OC2CCOC2)c2cc(C)sc2n1.
What is the InChIKey of 6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is YSASEGFVPLWXFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S/c1-3-5-15-14-16-12(19-10-4-6-18-8-10)11-7-9(2)20-13(11)17-14/h7,10H,3-6,8H2,1-2H3,(H,15,16,17).
What are the key properties of 6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine?
6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 293.39 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(oxolan-3-yloxy)-N-propylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103332717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).