N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide

C15H19N3OS — CID 110329205

IUPACN,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide
SMILESCCN(CC)C(=O)Cc1sc(-c2ccncc2)nc1C
InChIInChI=1S/C15H19N3OS/c1-4-18(5-2)14(19)10-13-11(3)17-15(20-13)12-6-8-16-9-7-12/h6-9H,4-5,10H2,1-3H3
InChIKeyBKLAUOCIVLTKSI-UHFFFAOYSA-N
MW289.40 g/mol
LogP2.92
Rot. Bonds5

About N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide

N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide (PubChem CID 110329205) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide
PubChem CID110329205
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC NameN,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide
SMILESCCN(CC)C(=O)Cc1sc(-c2ccncc2)nc1C
InChIInChI=1S/C15H19N3OS/c1-4-18(5-2)14(19)10-13-11(3)17-15(20-13)12-6-8-16-9-7-12/h6-9H,4-5,10H2,1-3H3
InChIKeyBKLAUOCIVLTKSI-UHFFFAOYSA-N
XLogP2.92
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide?
The IUPAC name of N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide (CID 110329205) is N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide.
What is the SMILES notation for N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide?
The canonical SMILES for N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide is CCN(CC)C(=O)Cc1sc(-c2ccncc2)nc1C.
What is the InChIKey of N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide?
The InChIKey is BKLAUOCIVLTKSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-4-18(5-2)14(19)10-13-11(3)17-15(20-13)12-6-8-16-9-7-12/h6-9H,4-5,10H2,1-3H3.
What are the key properties of N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide?
N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide has a molecular weight of 289.40 g/mol, XLogP of 2.92, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(4-methyl-2-pyridin-4-yl-1,3-thiazol-5-yl)acetamide is sourced from PubChem (CID 110329205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).