N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide

C17H20F2N4O2S — CID 141468418

IUPACN-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide
SMILESCc1nscc1C(=O)Nc1ccc(OCCN2CCC(F)(F)CC2)nc1
InChIInChI=1S/C17H20F2N4O2S/c1-12-14(11-26-22-12)16(24)21-13-2-3-15(20-10-13)25-9-8-23-6-4-17(18,19)5-7-23/h2-3,10-11H,4-9H2,1H3,(H,21,24)
InChIKeySAZWEEHYRZFUFK-UHFFFAOYSA-N
MW382.44 g/mol
LogP3.21
Rot. Bonds6

About N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide

N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide (PubChem CID 141468418) has the molecular formula C17H20F2N4O2S and a molecular weight of 382.44 g/mol. Its IUPAC name is N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide
PubChem CID141468418
Molecular FormulaC17H20F2N4O2S
Molecular Weight382.44 g/mol
Exact Mass382.13
IUPAC NameN-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide
SMILESCc1nscc1C(=O)Nc1ccc(OCCN2CCC(F)(F)CC2)nc1
InChIInChI=1S/C17H20F2N4O2S/c1-12-14(11-26-22-12)16(24)21-13-2-3-15(20-10-13)25-9-8-23-6-4-17(18,19)5-7-23/h2-3,10-11H,4-9H2,1H3,(H,21,24)
InChIKeySAZWEEHYRZFUFK-UHFFFAOYSA-N
XLogP3.21
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide with MolForge

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Related Compounds

N-[6-[1-(2-fluoroethyl)piperidin-3-yl]oxy-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide
CID 141468398
N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide
CID 84559427
3-ethoxy-N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]benzamide
CID 84559063
N-[6-(2-methoxyethoxy)-3-pyridinyl]-1-methylcyclohexane-1-carboxamide
CID 99621153
4-chloro-N-[6-(2-methoxyethoxy)-3-pyridinyl]pyridine-3-carboxamide
CID 81228254
N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1H-indole-6-carboxamide
CID 84561960
1-(3-chlorophenyl)-3-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]urea
CID 84559837
2-bromo-N-[6-(2-methoxyethoxy)-3-pyridinyl]pyridine-3-carboxamide
CID 103752362
3-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]propanamide
CID 55635310
2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide
CID 75375647
3-methyl-N-[3-(2-morpholin-4-ylethoxy)phenyl]-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 46969787
N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-(methylamino)acetamide
CID 43704151

Frequently Asked Questions

What is the IUPAC name of N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide?
The IUPAC name of N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide (CID 141468418) is N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide.
What is the SMILES notation for N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide?
The canonical SMILES for N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide is Cc1nscc1C(=O)Nc1ccc(OCCN2CCC(F)(F)CC2)nc1.
What is the InChIKey of N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide?
The InChIKey is SAZWEEHYRZFUFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20F2N4O2S/c1-12-14(11-26-22-12)16(24)21-13-2-3-15(20-10-13)25-9-8-23-6-4-17(18,19)5-7-23/h2-3,10-11H,4-9H2,1H3,(H,21,24).
What are the key properties of N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide?
N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide has a molecular weight of 382.44 g/mol, XLogP of 3.21, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[2-(4,4-difluoropiperidin-1-yl)ethoxy]-3-pyridinyl]-3-methyl-1,2-thiazole-4-carboxamide is sourced from PubChem (CID 141468418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).