6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine

C15H22N4OS — CID 103330123

IUPAC6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCCCNc1nc(NC2(C)CCOC2)c2cc(C)sc2n1
InChIInChI=1S/C15H22N4OS/c1-4-6-16-14-17-12(19-15(3)5-7-20-9-15)11-8-10(2)21-13(11)18-14/h8H,4-7,9H2,1-3H3,(H2,16,17,18,19)
InChIKeyIAIOSDDQOOSEJQ-UHFFFAOYSA-N
MW306.44 g/mol
LogP3.41
Rot. Bonds5

About 6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine

6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine (PubChem CID 103330123) has the molecular formula C15H22N4OS and a molecular weight of 306.44 g/mol. Its IUPAC name is 6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
PubChem CID103330123
Molecular FormulaC15H22N4OS
Molecular Weight306.44 g/mol
Exact Mass306.15
IUPAC Name6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCCCNc1nc(NC2(C)CCOC2)c2cc(C)sc2n1
InChIInChI=1S/C15H22N4OS/c1-4-6-16-14-17-12(19-15(3)5-7-20-9-15)11-8-10(2)21-13(11)18-14/h8H,4-7,9H2,1-3H3,(H2,16,17,18,19)
InChIKeyIAIOSDDQOOSEJQ-UHFFFAOYSA-N
XLogP3.41
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.44
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine with MolForge

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Related Compounds

[1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol
CID 103329347
3-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
CID 103324486
2-methyl-2-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
CID 103324837
2-N-ethyl-4-N-(3-methyloxolan-3-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103330122
4-N-hexan-3-yl-6-methyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103327093
2-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
CID 103324859
2-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324046
6-methyl-4-N-(2-methylsulfanylethyl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103328024
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
4-chloro-6-methyl-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 82309354

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine (CID 103330123) is 6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine is CCCNc1nc(NC2(C)CCOC2)c2cc(C)sc2n1.
What is the InChIKey of 6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is IAIOSDDQOOSEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4OS/c1-4-6-16-14-17-12(19-15(3)5-7-20-9-15)11-8-10(2)21-13(11)18-14/h8H,4-7,9H2,1-3H3,(H2,16,17,18,19).
What are the key properties of 6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine?
6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 306.44 g/mol, XLogP of 3.41, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 103330123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).