N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide

C14H16N2OS — CID 110372127

IUPACN,N-diethyl-3-(1,3-thiazol-2-yl)benzamide
SMILESCCN(CC)C(=O)c1cccc(-c2nccs2)c1
InChIInChI=1S/C14H16N2OS/c1-3-16(4-2)14(17)12-7-5-6-11(10-12)13-15-8-9-18-13/h5-10H,3-4H2,1-2H3
InChIKeyVPBCISUWMIITTL-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.29
Rot. Bonds4

About N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide

N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide (PubChem CID 110372127) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound NameN,N-diethyl-3-(1,3-thiazol-2-yl)benzamide
PubChem CID110372127
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC NameN,N-diethyl-3-(1,3-thiazol-2-yl)benzamide
SMILESCCN(CC)C(=O)c1cccc(-c2nccs2)c1
InChIInChI=1S/C14H16N2OS/c1-3-16(4-2)14(17)12-7-5-6-11(10-12)13-15-8-9-18-13/h5-10H,3-4H2,1-2H3
InChIKeyVPBCISUWMIITTL-UHFFFAOYSA-N
XLogP3.29
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-methyl-3-(1,3-thiazol-2-yl)benzamide
CID 110372097
(3R)-N,N-diethyl-1-[3-(1,3-thiazol-2-yl)benzoyl]piperidine-3-carboxamide
CID 126448230
N-[2-(dimethylsulfamoyl)ethyl]-3-(1,3-thiazol-2-yl)benzamide
CID 118780626
N,N-diethyl-3-(2-methylthieno[3,2-d]pyrimidin-4-yl)benzamide
CID 157018895
2-[3-(1-ethylpyrazol-3-yl)phenyl]-1,3-thiazole
CID 29150984
(4-methylpiperazin-1-yl)-[3-(1,3-thiazol-2-yl)phenyl]methanone
CID 110372090
N-[(2R,3S)-3-amino-4-(3,5-difluorophenyl)-2-hydroxybutyl]-N-[(3-ethylphenyl)methyl]-3-(1,3-thiazol-2-yl)benzamide;dihydrochloride
CID 69495632
N-[3-[3-(1,3-thiazol-2-yl)phenyl]propyl]acetamide
CID 142902094
N,N-diethyl-4-thiophen-2-ylbenzamide
CID 4730824
N,N-dimethyl-1-[3-(1,3-thiazol-2-yl)phenyl]methanamine
CID 173380030
(E)-3-[4-[(E)-2-phenyl-1-[3-(1,3-thiazol-2-yl)phenyl]but-1-enyl]phenyl]prop-2-enoic acid
CID 86271091
5-[3-(diethylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 72914641

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide (CID 110372127) is N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide is CCN(CC)C(=O)c1cccc(-c2nccs2)c1.
What is the InChIKey of N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide?
The InChIKey is VPBCISUWMIITTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-3-16(4-2)14(17)12-7-5-6-11(10-12)13-15-8-9-18-13/h5-10H,3-4H2,1-2H3.
What are the key properties of N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide?
N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide has a molecular weight of 260.36 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 110372127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).