N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide

C18H17FN4OS — CID 26005741

IUPACN-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide
SMILESCN(CC(=O)Nc1ccc(F)cc1)Cc1csc(-c2ccccn2)n1
InChIInChI=1S/C18H17FN4OS/c1-23(11-17(24)21-14-7-5-13(19)6-8-14)10-15-12-25-18(22-15)16-4-2-3-9-20-16/h2-9,12H,10-11H2,1H3,(H,21,24)
InChIKeyZBSYWRSQNUTVFX-UHFFFAOYSA-N
MW356.43 g/mol
LogP3.41
Rot. Bonds6

About N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide

N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide (PubChem CID 26005741) has the molecular formula C18H17FN4OS and a molecular weight of 356.43 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide
PubChem CID26005741
Molecular FormulaC18H17FN4OS
Molecular Weight356.43 g/mol
Exact Mass356.11
IUPAC NameN-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide
SMILESCN(CC(=O)Nc1ccc(F)cc1)Cc1csc(-c2ccccn2)n1
InChIInChI=1S/C18H17FN4OS/c1-23(11-17(24)21-14-7-5-13(19)6-8-14)10-15-12-25-18(22-15)16-4-2-3-9-20-16/h2-9,12H,10-11H2,1H3,(H,21,24)
InChIKeyZBSYWRSQNUTVFX-UHFFFAOYSA-N
XLogP3.41
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[(3S)-3-aminopiperidin-1-yl]-3-pyridinyl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 51002052
N4-benzyl-2-(3-pyridyl)-1,3-thiazole-4-carboxamide
CID 2824333
N-[4-[(3S,5R)-3-amino-5-methylpiperidin-1-yl]-3-pyridinyl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 44217530
N-[4-[(1R,3S,5S)-3-amino-5-methylcyclohexyl]-3-pyridinyl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 44217683
N-[4-[(3R,4R)-3-amino-4-fluoropiperidin-1-yl]-3-pyridinyl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 59455638
N-[4-(2-Pyridin-3-yl-thiazol-4-yl)-phenyl]-acetamide
CID 884114
1-(2,4-Difluorophenyl)-3-[4-(2-pyridinyl)-2-thiazolyl]urea
CID 4799115
3-(2-Fluorophenyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one
CID 5043540
N-[4-(2-Pyridin-3-yl-thiazol-4-yl)-phenyl]-butyramide
CID 6487931
1-(2-pyridinylmethyl)-N-[3-(1,3-thiazol-4-yl)phenyl]-4-piperidinecarboxamide
CID 24791083
N-(2-fluorophenyl)-2-pyridin-2-ylsulfanylacetamide
CID 2055031
2-(4-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide (CID 26005741) is N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide is CN(CC(=O)Nc1ccc(F)cc1)Cc1csc(-c2ccccn2)n1.
What is the InChIKey of N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide?
The InChIKey is ZBSYWRSQNUTVFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4OS/c1-23(11-17(24)21-14-7-5-13(19)6-8-14)10-15-12-25-18(22-15)16-4-2-3-9-20-16/h2-9,12H,10-11H2,1H3,(H,21,24).
What are the key properties of N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide?
N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide has a molecular weight of 356.43 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-[methyl-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]amino]acetamide is sourced from PubChem (CID 26005741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).