N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine

C16H17N3OS — CID 4225944

IUPACN-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
SMILESCOc1cccc(Nc2nc(C)nc3sc(C)c(C)c23)c1
InChIInChI=1S/C16H17N3OS/c1-9-10(2)21-16-14(9)15(17-11(3)18-16)19-12-6-5-7-13(8-12)20-4/h5-8H,1-4H3,(H,17,18,19)
InChIKeyQBMUCFQBGMLUKE-UHFFFAOYSA-N
MW299.40 g/mol
LogP4.37
Rot. Bonds3

About N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine

N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 4225944) has the molecular formula C16H17N3OS and a molecular weight of 299.40 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
PubChem CID4225944
Molecular FormulaC16H17N3OS
Molecular Weight299.40 g/mol
Exact Mass299.11
IUPAC NameN-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
SMILESCOc1cccc(Nc2nc(C)nc3sc(C)c(C)c23)c1
InChIInChI=1S/C16H17N3OS/c1-9-10(2)21-16-14(9)15(17-11(3)18-16)19-12-6-5-7-13(8-12)20-4/h5-8H,1-4H3,(H,17,18,19)
InChIKeyQBMUCFQBGMLUKE-UHFFFAOYSA-N
XLogP4.37
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.40
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-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

6-chloro-N-(3-methoxyphenyl)-2,5-dimethylpyrimidin-4-amine
CID 55229292
N-(3-fluoro-4-methylphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
CID 5066551
4-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]phenol
CID 28851372
3-[(2-chloro-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]phenol
CID 93214059
N-(3-methoxyphenyl)-2,3,4,7-tetramethyl-1-benzothiophen-6-amine
CID 12986991
N-[(2-methoxyphenyl)methyl]-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
CID 9283471
4-(3-bromoanilino)-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylic acid
CID 28855959
2-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 24557153
5,6-dimethyl-N-(3-pyrazin-2-yloxyphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 31980652
N,N-dimethyl-4-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzamide
CID 9184743
5-(4-chlorophenyl)-N-(3-methoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 21010171
2,5,6-trimethyl-4-(3-methylphenoxy)thieno[2,3-d]pyrimidine
CID 9213194

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine (CID 4225944) is N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine is COc1cccc(Nc2nc(C)nc3sc(C)c(C)c23)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is QBMUCFQBGMLUKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3OS/c1-9-10(2)21-16-14(9)15(17-11(3)18-16)19-12-6-5-7-13(8-12)20-4/h5-8H,1-4H3,(H,17,18,19).
What are the key properties of N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 299.40 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 4225944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).