5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide

C14H17N3O2S — CID 75450106

IUPAC5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide
SMILESCOCCCCC(=O)Nc1csc(-c2ccccn2)n1
InChIInChI=1S/C14H17N3O2S/c1-19-9-5-3-7-13(18)16-12-10-20-14(17-12)11-6-2-4-8-15-11/h2,4,6,8,10H,3,5,7,9H2,1H3,(H,16,18)
InChIKeyXKPYPYABWFIVOR-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.96
Rot. Bonds7

About 5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide

5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide (PubChem CID 75450106) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is 5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide.

Molecular Properties

Compound Name5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide
PubChem CID75450106
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC Name5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide
SMILESCOCCCCC(=O)Nc1csc(-c2ccccn2)n1
InChIInChI=1S/C14H17N3O2S/c1-19-9-5-3-7-13(18)16-12-10-20-14(17-12)11-6-2-4-8-15-11/h2,4,6,8,10H,3,5,7,9H2,1H3,(H,16,18)
InChIKeyXKPYPYABWFIVOR-UHFFFAOYSA-N
XLogP2.96
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]octadecanamide
CID 108748833
3-methoxy-4-[2-oxo-2-(propan-2-ylamino)ethoxy]-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)benzamide
CID 75450994
2-methoxy-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 43234329
N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]pentanamide
CID 108748809
N-(3-ethoxypropyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 32979634
N-(2,6-dimethylphenyl)-3-(2-pyridin-2-yl-1,3-thiazol-4-yl)propanamide
CID 110418418
2-chloro-N-(2-methoxyethyl)-4-[[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetyl]amino]benzamide
CID 55877767
N-[(2-methoxyphenyl)methyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 17435695
N-(2-aminophenyl)-5-methoxypentanamide
CID 119422437
5-methoxy-N-pyrazin-2-ylpentanamide
CID 75485096
N-(3-chloro-4-methoxyphenyl)-3-(2-pyridin-2-yl-1,3-thiazol-4-yl)propanamide
CID 110329818
N-[3-(methoxymethyl)phenyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 32638534

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide?
The IUPAC name of 5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide (CID 75450106) is 5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide.
What is the SMILES notation for 5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide?
The canonical SMILES for 5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide is COCCCCC(=O)Nc1csc(-c2ccccn2)n1.
What is the InChIKey of 5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide?
The InChIKey is XKPYPYABWFIVOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-19-9-5-3-7-13(18)16-12-10-20-14(17-12)11-6-2-4-8-15-11/h2,4,6,8,10H,3,5,7,9H2,1H3,(H,16,18).
What are the key properties of 5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide?
5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide has a molecular weight of 291.38 g/mol, XLogP of 2.96, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-(2-pyridin-2-yl-1,3-thiazol-4-yl)pentanamide is sourced from PubChem (CID 75450106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).