2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide

C15H18N2OS — CID 129204775

IUPAC2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide
SMILESCCCC(C(=O)NCc1nccs1)c1ccccc1
InChIInChI=1S/C15H18N2OS/c1-2-6-13(12-7-4-3-5-8-12)15(18)17-11-14-16-9-10-19-14/h3-5,7-10,13H,2,6,11H2,1H3,(H,17,18)
InChIKeyUBWRJVQVZUYLJR-UHFFFAOYSA-N
MW274.39 g/mol
LogP3.34
Rot. Bonds6

About 2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide

2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide (PubChem CID 129204775) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is 2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide.

Molecular Properties

Compound Name2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide
PubChem CID129204775
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC Name2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide
SMILESCCCC(C(=O)NCc1nccs1)c1ccccc1
InChIInChI=1S/C15H18N2OS/c1-2-6-13(12-7-4-3-5-8-12)15(18)17-11-14-16-9-10-19-14/h3-5,7-10,13H,2,6,11H2,1H3,(H,17,18)
InChIKeyUBWRJVQVZUYLJR-UHFFFAOYSA-N
XLogP3.34
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-2-phenyl-N-(1,3-thiazol-2-ylmethyl)propanamide
CID 62878373
2-amino-N-(1,3-thiazol-2-ylmethyl)pentanamide
CID 61283682
2-amino-4-phenyl-N-(1,3-thiazol-2-ylmethyl)butanamide
CID 114927829
2-phenyl-N-(1,3-thiazol-2-yl)butanamide
CID 2888884
N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-phenylpentanamide
CID 60607222
(2R)-2-amino-3-phenyl-N-(1,3-thiazol-2-ylmethyl)propanamide
CID 78985618
(2S)-2-amino-N-(1,3-thiazol-2-ylmethyl)butanamide
CID 79023405
(2S)-2-phenyl-N-(1,3-thiazol-2-ylmethyl)-2-thiomorpholin-4-ylacetamide
CID 95302146
2-(4-butyl-2,3-dioxopiperazin-1-yl)-2-phenyl-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 70782632
(2R)-2-(2-bromophenoxy)-N-(1,3-thiazol-2-ylmethyl)propanamide
CID 95623315
2-phenyl-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 110442320
2-phenyl-3-pyridin-2-yl-N-(pyridin-2-ylmethyl)propanamide
CID 110410528

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide?
The IUPAC name of 2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide (CID 129204775) is 2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide.
What is the SMILES notation for 2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide?
The canonical SMILES for 2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide is CCCC(C(=O)NCc1nccs1)c1ccccc1.
What is the InChIKey of 2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide?
The InChIKey is UBWRJVQVZUYLJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2OS/c1-2-6-13(12-7-4-3-5-8-12)15(18)17-11-14-16-9-10-19-14/h3-5,7-10,13H,2,6,11H2,1H3,(H,17,18).
What are the key properties of 2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide?
2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide has a molecular weight of 274.39 g/mol, XLogP of 3.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(1,3-thiazol-2-ylmethyl)pentanamide is sourced from PubChem (CID 129204775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).