N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine

C14H13N3S — CID 62188842

IUPACN-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine
SMILESCCNc1nc(-c2ccccc2)nc2sccc12
InChIInChI=1S/C14H13N3S/c1-2-15-13-11-8-9-18-14(11)17-12(16-13)10-6-4-3-5-7-10/h3-9H,2H2,1H3,(H,15,16,17)
InChIKeyJIEKQZCMCYQSHF-UHFFFAOYSA-N
MW255.35 g/mol
LogP3.79
Rot. Bonds3

About N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine

N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 62188842) has the molecular formula C14H13N3S and a molecular weight of 255.35 g/mol. Its IUPAC name is N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine
PubChem CID62188842
Molecular FormulaC14H13N3S
Molecular Weight255.35 g/mol
Exact Mass255.08
IUPAC NameN-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine
SMILESCCNc1nc(-c2ccccc2)nc2sccc12
InChIInChI=1S/C14H13N3S/c1-2-15-13-11-8-9-18-14(11)17-12(16-13)10-6-4-3-5-7-10/h3-9H,2H2,1H3,(H,15,16,17)
InChIKeyJIEKQZCMCYQSHF-UHFFFAOYSA-N
XLogP3.79
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.35
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-2-phenylthieno[2,3-d]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-phenyl-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 13038355
N-ethyl-2-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine
CID 55044626
2-(4-methylphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 63485547
N-ethyl-2-(2,3,4-trifluorophenyl)thieno[2,3-d]pyrimidin-4-amine
CID 107935507
4-N-benzyl-2-N-ethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324221
N-ethyl-2-[(N-methylanilino)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 62178950
2-(3-methoxyphenyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 62188855
2-cyclopropyl-N-ethylthieno[2,3-d]pyrimidin-4-amine
CID 62188847
N-ethyl-2-(methoxymethyl)thieno[2,3-d]pyrimidin-4-amine
CID 62194555
2-(4-fluorophenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 62188533
N-ethyl-2-[(2-methoxyphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 62188844
N-[bis(diethoxyphosphoryl)methyl]-2-(3-phenylphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 150386456

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine (CID 62188842) is N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine is CCNc1nc(-c2ccccc2)nc2sccc12.
What is the InChIKey of N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is JIEKQZCMCYQSHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3S/c1-2-15-13-11-8-9-18-14(11)17-12(16-13)10-6-4-3-5-7-10/h3-9H,2H2,1H3,(H,15,16,17).
What are the key properties of N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine?
N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 255.35 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-phenylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 62188842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).