2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine

C13H17N3OS — CID 80949925

IUPAC2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine
SMILESCCCc1nc(N)cc(OCCc2cccs2)n1
InChIInChI=1S/C13H17N3OS/c1-2-4-12-15-11(14)9-13(16-12)17-7-6-10-5-3-8-18-10/h3,5,8-9H,2,4,6-7H2,1H3,(H2,14,15,16)
InChIKeyMBRYWPWEXNZFSI-UHFFFAOYSA-N
MW263.37 g/mol
LogP2.69
Rot. Bonds6

About 2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine

2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine (PubChem CID 80949925) has the molecular formula C13H17N3OS and a molecular weight of 263.37 g/mol. Its IUPAC name is 2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine.

Molecular Properties

Compound Name2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine
PubChem CID80949925
Molecular FormulaC13H17N3OS
Molecular Weight263.37 g/mol
Exact Mass263.11
IUPAC Name2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine
SMILESCCCc1nc(N)cc(OCCc2cccs2)n1
InChIInChI=1S/C13H17N3OS/c1-2-4-12-15-11(14)9-13(16-12)17-7-6-10-5-3-8-18-10/h3,5,8-9H,2,4,6-7H2,1H3,(H2,14,15,16)
InChIKeyMBRYWPWEXNZFSI-UHFFFAOYSA-N
XLogP2.69
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.37
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-propyl-6-(2-thiophen-2-ylethoxy)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

2-propyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80949557
6-hexoxy-2-propylpyrimidin-4-amine
CID 80949907
4-(chloromethyl)-2-propyl-6-(2-thiophen-2-ylethoxy)pyridine
CID 113380852
6-[3-(2-methoxyethoxy)propoxy]-2-propylpyrimidin-4-amine
CID 103408442
2-propyl-4-N-(1-thiophen-2-ylpropan-2-yl)pyrimidine-4,6-diamine
CID 80950302
2-methyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80872816
4-propoxy-6-(2-thiophen-2-ylethoxy)-1,3,5-triazin-2-amine
CID 80873586
2-tert-butyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80962886
6-(2-propoxyphenoxy)-2-propylpyrimidin-4-amine
CID 80942785
4-morpholin-4-yl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine
CID 143049403
6-[(2-fluorophenyl)methoxy]-2-propylpyrimidin-4-amine
CID 80950511
2-propylpyrimidine-4,6-diamine
CID 67304918

Frequently Asked Questions

What is the IUPAC name of 2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine?
The IUPAC name of 2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine (CID 80949925) is 2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine.
What is the SMILES notation for 2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine?
The canonical SMILES for 2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine is CCCc1nc(N)cc(OCCc2cccs2)n1.
What is the InChIKey of 2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine?
The InChIKey is MBRYWPWEXNZFSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3OS/c1-2-4-12-15-11(14)9-13(16-12)17-7-6-10-5-3-8-18-10/h3,5,8-9H,2,4,6-7H2,1H3,(H2,14,15,16).
What are the key properties of 2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine?
2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine has a molecular weight of 263.37 g/mol, XLogP of 2.69, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine is sourced from PubChem (CID 80949925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).