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

C13H15N3OS — CID 86802898

IUPACN-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide
SMILESCCNC(=O)CNc1nc(-c2ccccc2)cs1
InChIInChI=1S/C13H15N3OS/c1-2-14-12(17)8-15-13-16-11(9-18-13)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H,14,17)(H,15,16)
InChIKeyHNGFUONFADDVQM-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.36
Rot. Bonds5

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

N-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide (PubChem CID 86802898) has the molecular formula C13H15N3OS and a molecular weight of 261.35 g/mol. Its IUPAC name is N-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide
PubChem CID86802898
Molecular FormulaC13H15N3OS
Molecular Weight261.35 g/mol
Exact Mass261.09
IUPAC NameN-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide
SMILESCCNC(=O)CNc1nc(-c2ccccc2)cs1
InChIInChI=1S/C13H15N3OS/c1-2-14-12(17)8-15-13-16-11(9-18-13)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H,14,17)(H,15,16)
InChIKeyHNGFUONFADDVQM-UHFFFAOYSA-N
XLogP2.36
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-phenyl-1,3-thiazol-2-yl)amino]butanoic acid
CID 43627750
methyl N-[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]carbamate
CID 47299409
2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethanol
CID 15573942
2-(4-ethylphenyl)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
CID 43951133
1,3-bis(4-phenyl-1,3-thiazol-2-yl)urea
CID 13089293
2-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]acetic acid
CID 82134209
4-oxo-4-[(4-phenyl-1,3-thiazol-2-yl)amino]butanoic acid
CID 804919
2-methyl-3-(methylamino)-N-(4-phenyl-1,3-thiazol-2-yl)propanamide
CID 119670232
2-amino-N-(4-phenyl-1,3-thiazol-2-yl)butanamide
CID 139386677
N-[4-[2-(benzylamino)-1,3-thiazol-4-yl]phenyl]butanamide
CID 9356285
methyl 5-[[(4-phenyl-1,3-thiazol-2-yl)amino]methyl]furan-2-carboxylate
CID 133387998
4-hydroxy-N-[2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]benzamide
CID 133371352

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide?
The IUPAC name of N-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide (CID 86802898) is N-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide.
What is the SMILES notation for N-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide?
The canonical SMILES for N-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide is CCNC(=O)CNc1nc(-c2ccccc2)cs1.
What is the InChIKey of N-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide?
The InChIKey is HNGFUONFADDVQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3OS/c1-2-14-12(17)8-15-13-16-11(9-18-13)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H,14,17)(H,15,16).
What are the key properties of N-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide?
N-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide has a molecular weight of 261.35 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(4-phenyl-1,3-thiazol-2-yl)amino]acetamide is sourced from PubChem (CID 86802898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).