7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine

C13H17N3S2 — CID 102686600

IUPAC7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NCC3(C)CCCS3)ncnc12
InChIInChI=1S/C13H17N3S2/c1-9-6-17-11-10(9)15-8-16-12(11)14-7-13(2)4-3-5-18-13/h6,8H,3-5,7H2,1-2H3,(H,14,15,16)
InChIKeyKUZKLNFKSQOFJH-UHFFFAOYSA-N
MW279.43 g/mol
LogP3.70
Rot. Bonds3

About 7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine

7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine (PubChem CID 102686600) has the molecular formula C13H17N3S2 and a molecular weight of 279.43 g/mol. Its IUPAC name is 7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine
PubChem CID102686600
Molecular FormulaC13H17N3S2
Molecular Weight279.43 g/mol
Exact Mass279.09
IUPAC Name7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NCC3(C)CCCS3)ncnc12
InChIInChI=1S/C13H17N3S2/c1-9-6-17-11-10(9)15-8-16-12(11)14-7-13(2)4-3-5-18-13/h6,8H,3-5,7H2,1-2H3,(H,14,15,16)
InChIKeyKUZKLNFKSQOFJH-UHFFFAOYSA-N
XLogP3.70
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine 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

7-methyl-N-[(4-methylpiperidin-4-yl)methyl]thieno[3,2-d]pyrimidin-4-amine
CID 102686960
5-bromo-6-N-ethyl-4-N-[(2-methylthiolan-2-yl)methyl]pyrimidine-4,6-diamine
CID 114072574
6-hydrazinyl-N-[(2-methylthiolan-2-yl)methyl]-5-propan-2-ylpyrimidin-4-amine
CID 80927117
3,6-dimethyl-N-[(2-methylthiolan-2-yl)methyl]pyrazin-2-amine
CID 80725115
1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine
CID 102686862
N-[1-(aminomethyl)cyclopropyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102687395
N'-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
CID 102686176
N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686423
7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine
CID 102686404
N-[[2-(aminomethyl)cyclohexyl]methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102687372
7-methyl-N-(2,2,3,3-tetramethylcyclopropyl)thieno[3,2-d]pyrimidin-4-amine
CID 102686575
7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine
CID 102686243

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of 7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine (CID 102686600) is 7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine is Cc1csc2c(NCC3(C)CCCS3)ncnc12.
What is the InChIKey of 7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine?
The InChIKey is KUZKLNFKSQOFJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3S2/c1-9-6-17-11-10(9)15-8-16-12(11)14-7-13(2)4-3-5-18-13/h6,8H,3-5,7H2,1-2H3,(H,14,15,16).
What are the key properties of 7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine?
7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine has a molecular weight of 279.43 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 102686600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).