N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine

C11H13N5S — CID 83190102

IUPACN-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
SMILESCNc1nc(-c2nccn2C)nc2c1CSC2
InChIInChI=1S/C11H13N5S/c1-12-9-7-5-17-6-8(7)14-10(15-9)11-13-3-4-16(11)2/h3-4H,5-6H2,1-2H3,(H,12,14,15)
InChIKeySSQCJPRJGVOCPI-UHFFFAOYSA-N
MW247.33 g/mol
LogP1.67
Rot. Bonds2

About N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine

N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine (PubChem CID 83190102) has the molecular formula C11H13N5S and a molecular weight of 247.33 g/mol. Its IUPAC name is N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
PubChem CID83190102
Molecular FormulaC11H13N5S
Molecular Weight247.33 g/mol
Exact Mass247.09
IUPAC NameN-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
SMILESCNc1nc(-c2nccn2C)nc2c1CSC2
InChIInChI=1S/C11H13N5S/c1-12-9-7-5-17-6-8(7)14-10(15-9)11-13-3-4-16(11)2/h3-4H,5-6H2,1-2H3,(H,12,14,15)
InChIKeySSQCJPRJGVOCPI-UHFFFAOYSA-N
XLogP1.67
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.33
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(1,3-dimethylpyrazol-4-yl)-N-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83201574
2-(2,6-dimethylphenyl)-N-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83200997
N-methyl-2-(1,3-thiazol-4-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83191389
N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83190550
4-methyl-2-(1-methylimidazol-2-yl)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114740201
2-(5-ethylfuran-2-yl)-N-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83201340
2-(3-chlorophenyl)-N-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83190443
2-(2,4-dichlorophenyl)-N-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83201654
2-(2-ethylphenyl)-N-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83200586
4-methyl-2-(1-methylimidazol-2-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 114737793
2-(4-bromo-5-chlorothiophen-2-yl)-N-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 102844127
2-(2-bromo-4-fluorophenyl)-N-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 107281484

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The IUPAC name of N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine (CID 83190102) is N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The canonical SMILES for N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine is CNc1nc(-c2nccn2C)nc2c1CSC2.
What is the InChIKey of N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The InChIKey is SSQCJPRJGVOCPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5S/c1-12-9-7-5-17-6-8(7)14-10(15-9)11-13-3-4-16(11)2/h3-4H,5-6H2,1-2H3,(H,12,14,15).
What are the key properties of N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine has a molecular weight of 247.33 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-methylimidazol-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 83190102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).