N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine

C12H15N3S — CID 102686423

IUPACN-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NC3CC3(C)C)ncnc12
InChIInChI=1S/C12H15N3S/c1-7-5-16-10-9(7)13-6-14-11(10)15-8-4-12(8,2)3/h5-6,8H,4H2,1-3H3,(H,13,14,15)
InChIKeyYBBWUEVKXQLUBK-UHFFFAOYSA-N
MW233.34 g/mol
LogP3.21
Rot. Bonds2

About N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine

N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine (PubChem CID 102686423) has the molecular formula C12H15N3S and a molecular weight of 233.34 g/mol. Its IUPAC name is N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
PubChem CID102686423
Molecular FormulaC12H15N3S
Molecular Weight233.34 g/mol
Exact Mass233.10
IUPAC NameN-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NC3CC3(C)C)ncnc12
InChIInChI=1S/C12H15N3S/c1-7-5-16-10-9(7)13-6-14-11(10)15-8-4-12(8,2)3/h5-6,8H,4H2,1-3H3,(H,13,14,15)
InChIKeyYBBWUEVKXQLUBK-UHFFFAOYSA-N
XLogP3.21
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-methyl-N-(2,2,3,3-tetramethylcyclopropyl)thieno[3,2-d]pyrimidin-4-amine
CID 102686575
N-cyclopent-3-en-1-yl-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686679
N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686255
4-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)cyclohexane-1,4-diamine
CID 102686178
1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)cycloheptane-1,2-diamine
CID 102686849
N-(2,3-dimethylcyclohexyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686234
N-[2-(aminomethyl)cyclohexyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686896
methyl 4-[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]cyclohexane-1-carboxylate
CID 102687139
7-methyl-N-(1-propylpiperidin-4-yl)thieno[3,2-d]pyrimidin-4-amine
CID 102686395
N-[1-(aminomethyl)cyclopropyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102687395
7-methyl-N-[(4-methylpiperidin-4-yl)methyl]thieno[3,2-d]pyrimidin-4-amine
CID 102686960
7-methyl-N-[(2-methylthiolan-2-yl)methyl]thieno[3,2-d]pyrimidin-4-amine
CID 102686600

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine (CID 102686423) is N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine is Cc1csc2c(NC3CC3(C)C)ncnc12.
What is the InChIKey of N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine?
The InChIKey is YBBWUEVKXQLUBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3S/c1-7-5-16-10-9(7)13-6-14-11(10)15-8-4-12(8,2)3/h5-6,8H,4H2,1-3H3,(H,13,14,15).
What are the key properties of N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine?
N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine has a molecular weight of 233.34 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 102686423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).