N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine

C17H20N6S — CID 141299425

IUPACN-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine
SMILESCCN1CCN(c2ccc(Nc3ncc4sccc4n3)cn2)CC1
InChIInChI=1S/C17H20N6S/c1-2-22-6-8-23(9-7-22)16-4-3-13(11-18-16)20-17-19-12-15-14(21-17)5-10-24-15/h3-5,10-12H,2,6-9H2,1H3,(H,19,20,21)
InChIKeySRBBXWUBFMYDDP-UHFFFAOYSA-N
MW340.46 g/mol
LogP2.97
Rot. Bonds4

About N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine

N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine (PubChem CID 141299425) has the molecular formula C17H20N6S and a molecular weight of 340.46 g/mol. Its IUPAC name is N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine.

Molecular Properties

Compound NameN-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine
PubChem CID141299425
Molecular FormulaC17H20N6S
Molecular Weight340.46 g/mol
Exact Mass340.15
IUPAC NameN-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine
SMILESCCN1CCN(c2ccc(Nc3ncc4sccc4n3)cn2)CC1
InChIInChI=1S/C17H20N6S/c1-2-22-6-8-23(9-7-22)16-4-3-13(11-18-16)20-17-19-12-15-14(21-17)5-10-24-15/h3-5,10-12H,2,6-9H2,1H3,(H,19,20,21)
InChIKeySRBBXWUBFMYDDP-UHFFFAOYSA-N
XLogP2.97
TPSA57.18 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.46
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-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

N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]thieno[3,2-d]pyrimidin-2-amine
CID 151602434
4-(4-ethylpiperazin-1-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidin-2-amine
CID 112888335
N-[3-fluoro-4-(4-methylsulfonylpiperazin-1-yl)phenyl]thieno[3,2-d]pyrimidin-2-amine
CID 141314550
1-N-[2-(dimethylamino)ethyl]-4-N-thieno[3,2-d]pyrimidin-2-ylbenzene-1,4-diamine
CID 141314561
1-ethyl-4-[5-[(4-ethylpiperazin-1-yl)methyl]-2-pyridinyl]piperazine
CID 155403164
4-(4-ethylpiperazin-1-yl)-N-(4-methylphenyl)pyrimidin-2-amine
CID 112888270
4-N-(1,3-benzothiazol-5-yl)-5-bromo-2-N-[4-(4-ethylpiperazin-1-yl)phenyl]pyrimidine-2,4-diamine
CID 91036521
4-(4-ethylpiperazin-1-yl)-N-(4-pyrrolidin-1-ylphenyl)pyrimidin-2-amine
CID 112888331
1-(5-tert-butyl-2-pyridinyl)-4-ethylpiperazine
CID 59019183
2,6-dichloro-N-[2-[[6-(4-propylpiperazin-1-yl)-3-pyridinyl]amino]pyrimidin-5-yl]benzamide
CID 58748688
N-(3-morpholin-4-ylpropyl)thieno[3,2-d]pyrimidin-2-amine
CID 91801780
6-[[5-fluoro-2-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]amino]pyrimidin-4-yl]amino]-1,2-dihydropyrido[2,3-b][1,4]oxazin-3-one
CID 67459709

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine?
The IUPAC name of N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine (CID 141299425) is N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine.
What is the SMILES notation for N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine?
The canonical SMILES for N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine is CCN1CCN(c2ccc(Nc3ncc4sccc4n3)cn2)CC1.
What is the InChIKey of N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine?
The InChIKey is SRBBXWUBFMYDDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6S/c1-2-22-6-8-23(9-7-22)16-4-3-13(11-18-16)20-17-19-12-15-14(21-17)5-10-24-15/h3-5,10-12H,2,6-9H2,1H3,(H,19,20,21).
What are the key properties of N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine?
N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine has a molecular weight of 340.46 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]thieno[3,2-d]pyrimidin-2-amine is sourced from PubChem (CID 141299425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).