1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine

C15H23N3S — CID 63198232

IUPAC1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine
SMILESCCc1cc2c(CC(NC)C(C)(C)C)ncnc2s1
InChIInChI=1S/C15H23N3S/c1-6-10-7-11-12(17-9-18-14(11)19-10)8-13(16-5)15(2,3)4/h7,9,13,16H,6,8H2,1-5H3
InChIKeyXQXBQCLAOYZRSY-UHFFFAOYSA-N
MW277.44 g/mol
LogP3.43
Rot. Bonds4

About 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine

1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine (PubChem CID 63198232) has the molecular formula C15H23N3S and a molecular weight of 277.44 g/mol. Its IUPAC name is 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine.

Molecular Properties

Compound Name1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine
PubChem CID63198232
Molecular FormulaC15H23N3S
Molecular Weight277.44 g/mol
Exact Mass277.16
IUPAC Name1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine
SMILESCCc1cc2c(CC(NC)C(C)(C)C)ncnc2s1
InChIInChI=1S/C15H23N3S/c1-6-10-7-11-12(17-9-18-14(11)19-10)8-13(16-5)15(2,3)4/h7,9,13,16H,6,8H2,1-5H3
InChIKeyXQXBQCLAOYZRSY-UHFFFAOYSA-N
XLogP3.43
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.44
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-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

1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)pentan-2-amine
CID 63196590
1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)pentan-2-one
CID 63198829
2-N-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-3-methylbutane-1,2-diamine
CID 65192081
3-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-hydroxy-2-methylpropanoic acid
CID 122061014
N-[1-chloro-2-(chloromethyl)butan-2-yl]-6-ethylthieno[2,3-d]pyrimidin-4-amine
CID 114010801
N-(3-chlorobutyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine
CID 65028734
2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]acetic acid
CID 650309
N-(1-chlorobutan-2-yl)-6-ethylthieno[2,3-d]pyrimidin-4-amine
CID 65027345
N-ethyl-N'-(6-ethylthieno[2,3-d]pyrimidin-4-yl)propane-1,3-diamine
CID 54906628
2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-N,N-bis(2-methylpropyl)acetamide
CID 39081674
N-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,N',2-trimethylpropane-1,3-diamine
CID 106918086
2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-N,N-dimethylacetamide
CID 31539204

Frequently Asked Questions

What is the IUPAC name of 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine?
The IUPAC name of 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine (CID 63198232) is 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine.
What is the SMILES notation for 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine?
The canonical SMILES for 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine is CCc1cc2c(CC(NC)C(C)(C)C)ncnc2s1.
What is the InChIKey of 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine?
The InChIKey is XQXBQCLAOYZRSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3S/c1-6-10-7-11-12(17-9-18-14(11)19-10)8-13(16-5)15(2,3)4/h7,9,13,16H,6,8H2,1-5H3.
What are the key properties of 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine?
1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine has a molecular weight of 277.44 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,3,3-trimethylbutan-2-amine is sourced from PubChem (CID 63198232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).