N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine

C10H13N3S2 — CID 103334551

IUPACN-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine
SMILESCNc1nc(SC(C)C)c2ccsc2n1
InChIInChI=1S/C10H13N3S2/c1-6(2)15-9-7-4-5-14-8(7)12-10(11-3)13-9/h4-6H,1-3H3,(H,11,12,13)
InChIKeyITMAVANEMQCTJT-UHFFFAOYSA-N
MW239.37 g/mol
LogP3.23
Rot. Bonds3

About N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine

N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103334551) has the molecular formula C10H13N3S2 and a molecular weight of 239.37 g/mol. Its IUPAC name is N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound NameN-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103334551
Molecular FormulaC10H13N3S2
Molecular Weight239.37 g/mol
Exact Mass239.06
IUPAC NameN-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine
SMILESCNc1nc(SC(C)C)c2ccsc2n1
InChIInChI=1S/C10H13N3S2/c1-6(2)15-9-7-4-5-14-8(7)12-10(11-3)13-9/h4-6H,1-3H3,(H,11,12,13)
InChIKeyITMAVANEMQCTJT-UHFFFAOYSA-N
XLogP3.23
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.37
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-4-propylsulfanylthieno[2,3-d]pyrimidin-2-amine
CID 103334188
N-methyl-4-(2-methylphenyl)sulfanylthieno[2,3-d]pyrimidin-2-amine
CID 103334534
3-[2-(ethylamino)thieno[2,3-d]pyrimidin-4-yl]sulfanylbutan-2-ol
CID 107772919
4-(2,5-difluorophenyl)sulfanyl-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103334423
4-(3,4-dichlorophenyl)sulfanyl-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103335037
N-methyl-4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]thieno[2,3-d]pyrimidin-2-amine
CID 103334519
4-(1H-imidazol-2-ylsulfanyl)-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 114001333
2-N-methyl-4-N-(4-methylpentan-2-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103324758
4-(3-fluorophenyl)sulfanyl-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103335232
2-N-methyl-4-N-(2-methylpentan-3-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103325944
2-N-methyl-4-N-(1-phenylethyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103324196
4-N-[1-(dimethylamino)propan-2-yl]-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103329471

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine (CID 103334551) is N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine is CNc1nc(SC(C)C)c2ccsc2n1.
What is the InChIKey of N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is ITMAVANEMQCTJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S2/c1-6(2)15-9-7-4-5-14-8(7)12-10(11-3)13-9/h4-6H,1-3H3,(H,11,12,13).
What are the key properties of N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine?
N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 239.37 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-propan-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103334551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).