N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide

C14H18N4OS — CID 133382765

IUPACN-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide
SMILESCCNC(=O)CN(CC)c1nnc(-c2ccccc2)s1
InChIInChI=1S/C14H18N4OS/c1-3-15-12(19)10-18(4-2)14-17-16-13(20-14)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3,(H,15,19)
InChIKeyRONJPUCUHRZEEZ-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.17
Rot. Bonds6

About N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide

N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide (PubChem CID 133382765) has the molecular formula C14H18N4OS and a molecular weight of 290.39 g/mol. Its IUPAC name is N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide
PubChem CID133382765
Molecular FormulaC14H18N4OS
Molecular Weight290.39 g/mol
Exact Mass290.12
IUPAC NameN-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide
SMILESCCNC(=O)CN(CC)c1nnc(-c2ccccc2)s1
InChIInChI=1S/C14H18N4OS/c1-3-15-12(19)10-18(4-2)14-17-16-13(20-14)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3,(H,15,19)
InChIKeyRONJPUCUHRZEEZ-UHFFFAOYSA-N
XLogP2.17
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide?
The IUPAC name of N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide (CID 133382765) is N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide.
What is the SMILES notation for N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide?
The canonical SMILES for N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide is CCNC(=O)CN(CC)c1nnc(-c2ccccc2)s1.
What is the InChIKey of N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide?
The InChIKey is RONJPUCUHRZEEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4OS/c1-3-15-12(19)10-18(4-2)14-17-16-13(20-14)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3,(H,15,19).
What are the key properties of N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide?
N-ethyl-2-[ethyl-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide has a molecular weight of 290.39 g/mol, XLogP of 2.17, 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-(5-phenyl-1,3,4-thiadiazol-2-yl)amino]acetamide is sourced from PubChem (CID 133382765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).