2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide

C14H17N3OS — CID 126830285

IUPAC2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide
SMILESCC(C)(C(=O)NCCc1ccccn1)c1nccs1
InChIInChI=1S/C14H17N3OS/c1-14(2,13-17-9-10-19-13)12(18)16-8-6-11-5-3-4-7-15-11/h3-5,7,9-10H,6,8H2,1-2H3,(H,16,18)
InChIKeyBYWWWURTAAMULO-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.17
Rot. Bonds5

About 2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide

2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide (PubChem CID 126830285) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is 2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide
PubChem CID126830285
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC Name2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide
SMILESCC(C)(C(=O)NCCc1ccccn1)c1nccs1
InChIInChI=1S/C14H17N3OS/c1-14(2,13-17-9-10-19-13)12(18)16-8-6-11-5-3-4-7-15-11/h3-5,7,9-10H,6,8H2,1-2H3,(H,16,18)
InChIKeyBYWWWURTAAMULO-UHFFFAOYSA-N
XLogP2.17
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide (CID 126830285) is 2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide is CC(C)(C(=O)NCCc1ccccn1)c1nccs1.
What is the InChIKey of 2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide?
The InChIKey is BYWWWURTAAMULO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-14(2,13-17-9-10-19-13)12(18)16-8-6-11-5-3-4-7-15-11/h3-5,7,9-10H,6,8H2,1-2H3,(H,16,18).
What are the key properties of 2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide?
2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide has a molecular weight of 275.38 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-pyridin-2-ylethyl)-2-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 126830285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).