4-(4-methylpyrimidin-5-yl)thiophen-2-amine

C9H9N3S — CID 82403333

IUPAC4-(4-methylpyrimidin-5-yl)thiophen-2-amine
SMILESCc1ncncc1-c1csc(N)c1
InChIInChI=1S/C9H9N3S/c1-6-8(3-11-5-12-6)7-2-9(10)13-4-7/h2-5H,10H2,1H3
InChIKeyTVEMEZOTOQUVTR-UHFFFAOYSA-N
MW191.26 g/mol
LogP2.10
Rot. Bonds1

About 4-(4-methylpyrimidin-5-yl)thiophen-2-amine

4-(4-methylpyrimidin-5-yl)thiophen-2-amine (PubChem CID 82403333) has the molecular formula C9H9N3S and a molecular weight of 191.26 g/mol. Its IUPAC name is 4-(4-methylpyrimidin-5-yl)thiophen-2-amine.

Molecular Properties

Compound Name4-(4-methylpyrimidin-5-yl)thiophen-2-amine
PubChem CID82403333
Molecular FormulaC9H9N3S
Molecular Weight191.26 g/mol
Exact Mass191.05
IUPAC Name4-(4-methylpyrimidin-5-yl)thiophen-2-amine
SMILESCc1ncncc1-c1csc(N)c1
InChIInChI=1S/C9H9N3S/c1-6-8(3-11-5-12-6)7-2-9(10)13-4-7/h2-5H,10H2,1H3
InChIKeyTVEMEZOTOQUVTR-UHFFFAOYSA-N
XLogP2.10
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.26
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(4-methylpyrimidin-5-yl)thiophen-2-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

4-methyl-5-(3-methylphenyl)pyrimidine
CID 178100912
4-(4-methylpyrimidin-5-yl)pyridine-2-sulfonamide
CID 90168227
ethane;3-(4-methylpyrimidin-5-yl)benzenesulfonamide
CID 144505728
(2R)-2-amino-2-[4-(4-methylpyrimidin-5-yl)phenyl]ethanol
CID 170955677
4-(4-methylpyrimidin-5-yl)benzoic acid
CID 105467481
6-(4-methylpyrimidin-5-yl)pyridin-2-amine
CID 82405870
4,6-dimethyl-2-pyridin-4-ylpyrimidine;ethane;4-methyl-5-phenylpyrimidine
CID 170732041
4-methyl-5-phenylthieno[2,3-d]pyrimidine
CID 118145924
4-(2-chloro-4-pyridinyl)thiophen-2-amine
CID 59011212
4,5-dimethylpyrimidine;hydrochloride
CID 126810746
2-(4-methylpyrimidin-5-yl)-1,3-thiazole-5-carbaldehyde
CID 130941438
3-(4-methylpyrimidin-5-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine
CID 121412465

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylpyrimidin-5-yl)thiophen-2-amine?
The IUPAC name of 4-(4-methylpyrimidin-5-yl)thiophen-2-amine (CID 82403333) is 4-(4-methylpyrimidin-5-yl)thiophen-2-amine.
What is the SMILES notation for 4-(4-methylpyrimidin-5-yl)thiophen-2-amine?
The canonical SMILES for 4-(4-methylpyrimidin-5-yl)thiophen-2-amine is Cc1ncncc1-c1csc(N)c1.
What is the InChIKey of 4-(4-methylpyrimidin-5-yl)thiophen-2-amine?
The InChIKey is TVEMEZOTOQUVTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3S/c1-6-8(3-11-5-12-6)7-2-9(10)13-4-7/h2-5H,10H2,1H3.
What are the key properties of 4-(4-methylpyrimidin-5-yl)thiophen-2-amine?
4-(4-methylpyrimidin-5-yl)thiophen-2-amine has a molecular weight of 191.26 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpyrimidin-5-yl)thiophen-2-amine is sourced from PubChem (CID 82403333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).