N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide

C14H16N2OS — CID 134058026

IUPACN-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide
SMILESCCN(C)C(=O)c1sc(-c2ccccc2)nc1C
InChIInChI=1S/C14H16N2OS/c1-4-16(3)14(17)12-10(2)15-13(18-12)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3
InChIKeyCQRTXKZOTZBZSX-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.21
Rot. Bonds3

About N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide

N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide (PubChem CID 134058026) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide
PubChem CID134058026
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC NameN-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide
SMILESCCN(C)C(=O)c1sc(-c2ccccc2)nc1C
InChIInChI=1S/C14H16N2OS/c1-4-16(3)14(17)12-10(2)15-13(18-12)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3
InChIKeyCQRTXKZOTZBZSX-UHFFFAOYSA-N
XLogP3.21
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,4-dimethyl-2-phenyl-N-(3-phenylpropyl)-1,3-thiazole-5-carboxamide
CID 55710205
N-benzyl-N,4-dimethyl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
CID 39080833
N-[2-(diethylamino)ethyl]-2-(4-iodophenyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide
CID 143445165
2-hydroxy-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)ethanone
CID 14318557
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide
CID 18156517
4-methyl-2-phenyl-1,3-thiazole-5-carboxylate
CID 4319506
N-ethyl-N,2,4-trimethyl-1,3-thiazole-5-carboxamide
CID 130667065
methanidyl-(4-methyl-2-phenyl-1,3-thiazole-5-carbonyl)azanium
CID 59280512
3-[[2-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]-methylamino]propanoic acid
CID 119362912
2-(4-butylphenyl)-N,4-dimethyl-N-propyl-1,3-thiazole-5-carboxamide
CID 143281454
N-[2-(diethylamino)ethyl]-N,4-dimethyl-2-(4-propan-2-ylphenyl)-1,3-thiazole-5-carboxamide
CID 59338611
3-hydroxy-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)prop-2-en-1-one
CID 172677917

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide (CID 134058026) is N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide is CCN(C)C(=O)c1sc(-c2ccccc2)nc1C.
What is the InChIKey of N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide?
The InChIKey is CQRTXKZOTZBZSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-4-16(3)14(17)12-10(2)15-13(18-12)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3.
What are the key properties of N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide?
N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide has a molecular weight of 260.36 g/mol, XLogP of 3.21, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,4-dimethyl-2-phenyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 134058026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).