N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide

C17H19F3N4O2 — CID 162379788

IUPACN-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide
SMILESCCCN(C[C@@H](O)c1cccnc1)C(=O)Cc1ccc(C(F)(F)F)nn1
InChIInChI=1S/C17H19F3N4O2/c1-2-8-24(11-14(25)12-4-3-7-21-10-12)16(26)9-13-5-6-15(23-22-13)17(18,19)20/h3-7,10,14,25H,2,8-9,11H2,1H3/t14-/m1/s1
InChIKeyHHPQAABHYSSVHU-CQSZACIVSA-N
MW368.36 g/mol
LogP2.41
Rot. Bonds7

About N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide

N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide (PubChem CID 162379788) has the molecular formula C17H19F3N4O2 and a molecular weight of 368.36 g/mol. Its IUPAC name is N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide.

Molecular Properties

Compound NameN-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide
PubChem CID162379788
Molecular FormulaC17H19F3N4O2
Molecular Weight368.36 g/mol
Exact Mass368.15
IUPAC NameN-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide
SMILESCCCN(C[C@@H](O)c1cccnc1)C(=O)Cc1ccc(C(F)(F)F)nn1
InChIInChI=1S/C17H19F3N4O2/c1-2-8-24(11-14(25)12-4-3-7-21-10-12)16(26)9-13-5-6-15(23-22-13)17(18,19)20/h3-7,10,14,25H,2,8-9,11H2,1H3/t14-/m1/s1
InChIKeyHHPQAABHYSSVHU-CQSZACIVSA-N
XLogP2.41
TPSA79.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.36
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5-hydroxy-3-methyl-5-pyridin-3-yl-4H-pyrazol-1-yl)-2-phenylethanone
CID 2877858
N-cyclobutyl-N-(2-hydroxy-2-pyrazin-2-ylethyl)-2-[6-(trifluoromethyl)-3-pyridinyl]acetamide
CID 162379647
N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-(oxetan-3-ylmethyl)-2-[6-(trifluoromethyl)-3-pyridinyl]acetamide
CID 162379650
Preparation of N-[(2S)-2-Hydroxy-2-(3-Pyridyl)Ethyl]-N-Propyl-2-[6-(Trifluoromethyl)-3-Pyridyl]Acetamide
CID 162379661
tert-butyl N-[5-[[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-[2-[6-(trifluoromethyl)-3-pyridinyl]acetyl]amino]pentyl]carbamate
CID 162379665
N-[2-hydroxy-2-(4-methyl-3-pyridinyl)ethyl]-N-(oxetan-3-ylmethyl)-2-[6-(trifluoromethyl)-3-pyridinyl]acetamide
CID 162379668
N-[2-hydroxy-2-(4-propan-2-yl-3-pyridinyl)ethyl]-N-(oxetan-3-ylmethyl)-2-[6-(trifluoromethyl)-3-pyridinyl]acetamide
CID 162379679
N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[5-(trifluoromethyl)-2-pyridinyl]acetamide
CID 162379695
N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propan-2-yl-2-[6-(trifluoromethyl)-3-pyridinyl]acetamide
CID 162379713
tert-butyl N-[2-[[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-[2-[6-(trifluoromethyl)-3-pyridinyl]acetyl]amino]ethyl]carbamate
CID 162379714
N-benzyl-N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-2-[6-(trifluoromethyl)-3-pyridinyl]acetamide
CID 162379727
N-cyclobutyl-N-(2-hydroxy-2-pyridazin-3-ylethyl)-2-[6-(trifluoromethyl)-3-pyridinyl]acetamide
CID 162379754

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide?
The IUPAC name of N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide (CID 162379788) is N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide.
What is the SMILES notation for N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide?
The canonical SMILES for N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide is CCCN(C[C@@H](O)c1cccnc1)C(=O)Cc1ccc(C(F)(F)F)nn1.
What is the InChIKey of N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide?
The InChIKey is HHPQAABHYSSVHU-CQSZACIVSA-N. The full InChI is InChI=1S/C17H19F3N4O2/c1-2-8-24(11-14(25)12-4-3-7-21-10-12)16(26)9-13-5-6-15(23-22-13)17(18,19)20/h3-7,10,14,25H,2,8-9,11H2,1H3/t14-/m1/s1.
What are the key properties of N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide?
N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide has a molecular weight of 368.36 g/mol, XLogP of 2.41, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-hydroxy-2-pyridin-3-ylethyl]-N-propyl-2-[6-(trifluoromethyl)pyridazin-3-yl]acetamide is sourced from PubChem (CID 162379788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).