N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide

C22H25N3OS — CID 18271681

IUPACN-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide
SMILESCCN(CC)C(CNC(=O)c1csc(-c2ccccc2)n1)c1ccccc1
InChIInChI=1S/C22H25N3OS/c1-3-25(4-2)20(17-11-7-5-8-12-17)15-23-21(26)19-16-27-22(24-19)18-13-9-6-10-14-18/h5-14,16,20H,3-4,15H2,1-2H3,(H,23,26)
InChIKeyNEGVMDJZRRCBIR-UHFFFAOYSA-N
MW379.53 g/mol
LogP4.62
Rot. Bonds8

About N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide

N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide (PubChem CID 18271681) has the molecular formula C22H25N3OS and a molecular weight of 379.53 g/mol. Its IUPAC name is N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide
PubChem CID18271681
Molecular FormulaC22H25N3OS
Molecular Weight379.53 g/mol
Exact Mass379.17
IUPAC NameN-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide
SMILESCCN(CC)C(CNC(=O)c1csc(-c2ccccc2)n1)c1ccccc1
InChIInChI=1S/C22H25N3OS/c1-3-25(4-2)20(17-11-7-5-8-12-17)15-23-21(26)19-16-27-22(24-19)18-13-9-6-10-14-18/h5-14,16,20H,3-4,15H2,1-2H3,(H,23,26)
InChIKeyNEGVMDJZRRCBIR-UHFFFAOYSA-N
XLogP4.62
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.53
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide 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-[(2R)-2-phenylpropyl]-1,3-thiazole-4-carboxamide
CID 9457088
N-ethyl-2-phenyl-1,3-thiazole-4-carboxamide
CID 17398194
N-[2-(diethylamino)-2-phenylethyl]pyridine-2-carboxamide
CID 42917068
2-(3,4-dimethoxyphenyl)-N-[(2S)-2-(dimethylamino)-2-phenylethyl]-1,3-thiazole-4-carboxamide
CID 27231015
N-[2-hydroxy-2-(4-methylsulfanylphenyl)ethyl]-2-phenyl-1,3-thiazole-4-carboxamide
CID 71803828
N-octadecyl-2-phenyl-1,3-thiazole-4-carboxamide
CID 11259615
N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide
CID 47082097
2,2-dimethyl-3-[(2-phenyl-1,3-thiazole-4-carbonyl)amino]propanoic acid
CID 119249287
N-[2-(diethylamino)-2-phenylethyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
CID 18167064
2-phenyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-4-carboxamide
CID 18105647
N-[(2-methylphenyl)methyl]-2-phenyl-1,3-thiazole-4-carboxamide
CID 9488971
N-amino-N-hydrazinyl-2-phenyl-1,3-thiazole-4-carboxamide
CID 141311933

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide (CID 18271681) is N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide is CCN(CC)C(CNC(=O)c1csc(-c2ccccc2)n1)c1ccccc1.
What is the InChIKey of N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide?
The InChIKey is NEGVMDJZRRCBIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3OS/c1-3-25(4-2)20(17-11-7-5-8-12-17)15-23-21(26)19-16-27-22(24-19)18-13-9-6-10-14-18/h5-14,16,20H,3-4,15H2,1-2H3,(H,23,26).
What are the key properties of N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide?
N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide has a molecular weight of 379.53 g/mol, XLogP of 4.62, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)-2-phenylethyl]-2-phenyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 18271681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).