2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide

C14H17N3O2S — CID 106383389

IUPAC2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
SMILESCCNc1ccc(C)cc1C(=O)NCc1csc(=O)[nH]1
InChIInChI=1S/C14H17N3O2S/c1-3-15-12-5-4-9(2)6-11(12)13(18)16-7-10-8-20-14(19)17-10/h4-6,8,15H,3,7H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyFYPTWRIYEWWZTB-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.11
Rot. Bonds5

About 2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide

2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide (PubChem CID 106383389) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is 2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide.

Molecular Properties

Compound Name2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
PubChem CID106383389
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC Name2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
SMILESCCNc1ccc(C)cc1C(=O)NCc1csc(=O)[nH]1
InChIInChI=1S/C14H17N3O2S/c1-3-15-12-5-4-9(2)6-11(12)13(18)16-7-10-8-20-14(19)17-10/h4-6,8,15H,3,7H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyFYPTWRIYEWWZTB-UHFFFAOYSA-N
XLogP2.11
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
CID 113341004
5-chloro-2-(methylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
CID 106383388
2-(ethylamino)-5-methyl-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 63824195
2-(ethylamino)-5-methyl-N-propylbenzamide
CID 62509654
N-[(4,5-dimethylthiophen-2-yl)methyl]-2-(ethylamino)-5-methylbenzamide
CID 65245704
2-(ethylamino)-5-methyl-N-[(6-methyl-2-pyridinyl)methyl]benzamide
CID 62510285
2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide
CID 106383412
2-amino-5-bromo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
CID 106382415
N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide
CID 103775054
N-[2-(dimethylamino)propyl]-2-(ethylamino)-5-methylbenzamide
CID 62508874
2-amino-5-fluoro-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
CID 114181175
3-amino-2-ethoxy-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
CID 106379162

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide?
The IUPAC name of 2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide (CID 106383389) is 2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide.
What is the SMILES notation for 2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide?
The canonical SMILES for 2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide is CCNc1ccc(C)cc1C(=O)NCc1csc(=O)[nH]1.
What is the InChIKey of 2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide?
The InChIKey is FYPTWRIYEWWZTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-3-15-12-5-4-9(2)6-11(12)13(18)16-7-10-8-20-14(19)17-10/h4-6,8,15H,3,7H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of 2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide?
2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide has a molecular weight of 291.38 g/mol, XLogP of 2.11, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide is sourced from PubChem (CID 106383389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).