N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine

C15H15N3S — CID 55248382

IUPACN,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCNc1nc(-c2ccccc2C)nc2sc(C)cc12
InChIInChI=1S/C15H15N3S/c1-9-6-4-5-7-11(9)14-17-13(16-3)12-8-10(2)19-15(12)18-14/h4-8H,1-3H3,(H,16,17,18)
InChIKeyFUWXYZMDSRDILJ-UHFFFAOYSA-N
MW269.37 g/mol
LogP4.02
Rot. Bonds2

About N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine

N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 55248382) has the molecular formula C15H15N3S and a molecular weight of 269.37 g/mol. Its IUPAC name is N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID55248382
Molecular FormulaC15H15N3S
Molecular Weight269.37 g/mol
Exact Mass269.10
IUPAC NameN,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCNc1nc(-c2ccccc2C)nc2sc(C)cc12
InChIInChI=1S/C15H15N3S/c1-9-6-4-5-7-11(9)14-17-13(16-3)12-8-10(2)19-15(12)18-14/h4-8H,1-3H3,(H,16,17,18)
InChIKeyFUWXYZMDSRDILJ-UHFFFAOYSA-N
XLogP4.02
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine (CID 55248382) is N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine is CNc1nc(-c2ccccc2C)nc2sc(C)cc12.
What is the InChIKey of N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is FUWXYZMDSRDILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3S/c1-9-6-4-5-7-11(9)14-17-13(16-3)12-8-10(2)19-15(12)18-14/h4-8H,1-3H3,(H,16,17,18).
What are the key properties of N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine?
N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 269.37 g/mol, XLogP of 4.02, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-2-(2-methylphenyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 55248382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).