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

C15H15N3S — CID 102686243

IUPAC7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine
SMILESCc1ccc(CNc2ncnc3c(C)csc23)cc1
InChIInChI=1S/C15H15N3S/c1-10-3-5-12(6-4-10)7-16-15-14-13(17-9-18-15)11(2)8-19-14/h3-6,8-9H,7H2,1-2H3,(H,16,17,18)
InChIKeyYYFGPCLZSDEELZ-UHFFFAOYSA-N
MW269.37 g/mol
LogP3.92
Rot. Bonds3

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

7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine (PubChem CID 102686243) has the molecular formula C15H15N3S and a molecular weight of 269.37 g/mol. Its IUPAC name is 7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine
PubChem CID102686243
Molecular FormulaC15H15N3S
Molecular Weight269.37 g/mol
Exact Mass269.10
IUPAC Name7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine
SMILESCc1ccc(CNc2ncnc3c(C)csc23)cc1
InChIInChI=1S/C15H15N3S/c1-10-3-5-12(6-4-10)7-16-15-14-13(17-9-18-15)11(2)8-19-14/h3-6,8-9H,7H2,1-2H3,(H,16,17,18)
InChIKeyYYFGPCLZSDEELZ-UHFFFAOYSA-N
XLogP3.92
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-chlorophenyl)methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686195
2-[[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]methyl]phenol
CID 102686720
7-methyl-N-[1-(4-methylphenyl)ethyl]thieno[3,2-d]pyrimidin-4-amine
CID 102686398
N-[[2-(aminomethyl)phenyl]methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686834
7-methyl-N-(1,2-oxazol-5-ylmethyl)thieno[3,2-d]pyrimidin-4-amine
CID 106419173
N,2-dimethyl-N'-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
CID 102686940
1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine
CID 102686862
2-methyl-N'-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
CID 102687370
N-[(3-ethyl-2-pyridinyl)methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686617
N'-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
CID 102686176
4-[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]butan-1-ol
CID 106842572
N-but-3-enyl-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686671

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of 7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine (CID 102686243) is 7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine is Cc1ccc(CNc2ncnc3c(C)csc23)cc1.
What is the InChIKey of 7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine?
The InChIKey is YYFGPCLZSDEELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3S/c1-10-3-5-12(6-4-10)7-16-15-14-13(17-9-18-15)11(2)8-19-14/h3-6,8-9H,7H2,1-2H3,(H,16,17,18).
What are the key properties of 7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine?
7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine has a molecular weight of 269.37 g/mol, XLogP of 3.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 102686243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).