4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine

C13H13N5S — CID 103324894

IUPAC4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine
SMILESCC(Nc1nc(N)nc2sccc12)c1ccccn1
InChIInChI=1S/C13H13N5S/c1-8(10-4-2-3-6-15-10)16-11-9-5-7-19-12(9)18-13(14)17-11/h2-8H,1H3,(H3,14,16,17,18)
InChIKeyYMWPGPLPJVOHCF-UHFFFAOYSA-N
MW271.35 g/mol
LogP2.84
Rot. Bonds3

About 4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine

4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine (PubChem CID 103324894) has the molecular formula C13H13N5S and a molecular weight of 271.35 g/mol. Its IUPAC name is 4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine
PubChem CID103324894
Molecular FormulaC13H13N5S
Molecular Weight271.35 g/mol
Exact Mass271.09
IUPAC Name4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine
SMILESCC(Nc1nc(N)nc2sccc12)c1ccccn1
InChIInChI=1S/C13H13N5S/c1-8(10-4-2-3-6-15-10)16-11-9-5-7-19-12(9)18-13(14)17-11/h2-8H,1H3,(H3,14,16,17,18)
InChIKeyYMWPGPLPJVOHCF-UHFFFAOYSA-N
XLogP2.84
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.35
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine 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

8-fluoro-4-N-[(1R)-1-pyridin-2-ylethyl]quinazoline-2,4-diamine
CID 118423308
2-[(2-aminothieno[2,3-d]pyrimidin-4-yl)amino]propanamide
CID 103325001
6-N-(1-pyridin-2-ylethyl)-7H-purine-2,6-diamine
CID 115669349
4-N-[1-(3-fluoro-4-methylphenyl)ethyl]thieno[2,3-d]pyrimidine-2,4-diamine
CID 103329097
N-(1-pyridin-2-ylethyl)thieno[3,2-d]pyrimidin-4-amine
CID 17418978
8,9-dimethyl-6-N-(1-pyridin-2-ylethyl)purine-2,6-diamine
CID 56730239
4-N-(1-pyridin-2-ylethyl)pyrimidine-4,5-diamine
CID 79916401
4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103324290
2,5-dimethyl-4-N-(1-pyridin-2-ylethyl)pyrimidine-4,6-diamine
CID 80781352
3-bromo-2-N-(1-pyridin-2-ylethyl)pyridine-2,5-diamine
CID 79531784
2-[(2-aminothieno[2,3-d]pyrimidin-4-yl)amino]-N-cyclopropylpropanamide
CID 103329768
3-[(2-aminothieno[2,3-d]pyrimidin-4-yl)amino]-4-methoxybutan-1-ol
CID 106163052

Frequently Asked Questions

What is the IUPAC name of 4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine (CID 103324894) is 4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine is CC(Nc1nc(N)nc2sccc12)c1ccccn1.
What is the InChIKey of 4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is YMWPGPLPJVOHCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5S/c1-8(10-4-2-3-6-15-10)16-11-9-5-7-19-12(9)18-13(14)17-11/h2-8H,1H3,(H3,14,16,17,18).
What are the key properties of 4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine?
4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 271.35 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(1-pyridin-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 103324894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).