N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide

C19H22N4OS — CID 9337907

IUPACN-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide
SMILESCCNC(=O)CN(CC)c1nc(C)nc2scc(-c3ccccc3)c12
InChIInChI=1S/C19H22N4OS/c1-4-20-16(24)11-23(5-2)18-17-15(14-9-7-6-8-10-14)12-25-19(17)22-13(3)21-18/h6-10,12H,4-5,11H2,1-3H3,(H,20,24)
InChIKeyGZVNDDGRFLOBAT-UHFFFAOYSA-N
MW354.48 g/mol
LogP3.63
Rot. Bonds6

About N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide

N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide (PubChem CID 9337907) has the molecular formula C19H22N4OS and a molecular weight of 354.48 g/mol. Its IUPAC name is N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide
PubChem CID9337907
Molecular FormulaC19H22N4OS
Molecular Weight354.48 g/mol
Exact Mass354.15
IUPAC NameN-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide
SMILESCCNC(=O)CN(CC)c1nc(C)nc2scc(-c3ccccc3)c12
InChIInChI=1S/C19H22N4OS/c1-4-20-16(24)11-23(5-2)18-17-15(14-9-7-6-8-10-14)12-25-19(17)22-13(3)21-18/h6-10,12H,4-5,11H2,1-3H3,(H,20,24)
InChIKeyGZVNDDGRFLOBAT-UHFFFAOYSA-N
XLogP3.63
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.48
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-hydroxyethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
CID 28848884
2-[2-hydroxyethyl-[2-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethanol
CID 28848888
N-ethyl-2-[ethyl-(3-methylquinoxalin-2-yl)amino]acetamide
CID 133382747
N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide
CID 133382765
N,N-dimethyl-2-[4-[(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]pyrazol-1-yl]acetamide
CID 133276092
N-[(3R)-1,1-dioxothiolan-3-yl]-N,2-dimethyl-5-phenylthieno[2,3-d]pyrimidin-4-amine
CID 8560450
(1R)-2-[(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-1-phenylethanol
CID 9311855
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-2-[5-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetamide
CID 8573297
N-tert-butyl-2-[ethyl-(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide
CID 9113082
N-ethyl-2-[N-(2-hydroxyethyl)anilino]acetamide
CID 110880306
2-[[2-[(dimethylamino)methyl]-5-phenylthieno[2,3-d]pyrimidin-4-yl]amino]propanoic acid
CID 122058325
2-methyl-5-phenyl-4-(4-propylpiperazin-4-ium-1-yl)thieno[2,3-d]pyrimidine
CID 7874202

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide?
The IUPAC name of N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide (CID 9337907) is N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide.
What is the SMILES notation for N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide?
The canonical SMILES for N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide is CCNC(=O)CN(CC)c1nc(C)nc2scc(-c3ccccc3)c12.
What is the InChIKey of N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide?
The InChIKey is GZVNDDGRFLOBAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4OS/c1-4-20-16(24)11-23(5-2)18-17-15(14-9-7-6-8-10-14)12-25-19(17)22-13(3)21-18/h6-10,12H,4-5,11H2,1-3H3,(H,20,24).
What are the key properties of N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide?
N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide has a molecular weight of 354.48 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[ethyl-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide is sourced from PubChem (CID 9337907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).