N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide

C18H21FN4O — CID 71862457

IUPACN-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide
SMILESCC(=O)NC1CCCN(c2nnc(-c3cccc(F)c3)cc2C)C1
InChIInChI=1S/C18H21FN4O/c1-12-9-17(14-5-3-6-15(19)10-14)21-22-18(12)23-8-4-7-16(11-23)20-13(2)24/h3,5-6,9-10,16H,4,7-8,11H2,1-2H3,(H,20,24)
InChIKeyDHKFGYSSSAFRLY-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.70
Rot. Bonds3

About N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide

N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide (PubChem CID 71862457) has the molecular formula C18H21FN4O and a molecular weight of 328.39 g/mol. Its IUPAC name is N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide
PubChem CID71862457
Molecular FormulaC18H21FN4O
Molecular Weight328.39 g/mol
Exact Mass328.17
IUPAC NameN-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide
SMILESCC(=O)NC1CCCN(c2nnc(-c3cccc(F)c3)cc2C)C1
InChIInChI=1S/C18H21FN4O/c1-12-9-17(14-5-3-6-15(19)10-14)21-22-18(12)23-8-4-7-16(11-23)20-13(2)24/h3,5-6,9-10,16H,4,7-8,11H2,1-2H3,(H,20,24)
InChIKeyDHKFGYSSSAFRLY-UHFFFAOYSA-N
XLogP2.70
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-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

trans-(1R,2R)-2-[4-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperazin-1-yl]cyclopentan-1-ol
CID 146146695
(3aS,6aR)-2-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-3a-carboxylic acid
CID 122063274
N-[1-(5-bromo-3-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 133359713
N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124519191
N-[1-(3-fluorophenyl)sulfonylpiperidin-3-yl]acetamide
CID 47304951
N-[1-(5-methoxyquinazolin-4-yl)piperidin-3-yl]acetamide
CID 138042775
N-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-3-yl]acetamide
CID 133489997
N-[1-[2-(3-fluorophenoxy)propanoyl]piperidin-3-yl]acetamide
CID 87005926
N-[1-[2-amino-5-(6-amino-3-pyridinyl)-6-methylpyrimidin-4-yl]piperidin-3-yl]acetamide
CID 70671781
N-[1-[6-(5-bromo-2-hydroxyphenyl)-4-(3-fluorophenyl)-2-pyridinyl]pyrrolidin-3-yl]acetamide
CID 137307071
N-[1-(3-fluorophenyl)piperidin-3-yl]-2-methyl-3-(methylamino)propanamide;dihydrochloride
CID 119884155
N-[(3R)-1-(3-fluorobenzoyl)pyrrolidin-3-yl]acetamide
CID 95051605

Frequently Asked Questions

What is the IUPAC name of N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide?
The IUPAC name of N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide (CID 71862457) is N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide.
What is the SMILES notation for N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide?
The canonical SMILES for N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide is CC(=O)NC1CCCN(c2nnc(-c3cccc(F)c3)cc2C)C1.
What is the InChIKey of N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide?
The InChIKey is DHKFGYSSSAFRLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN4O/c1-12-9-17(14-5-3-6-15(19)10-14)21-22-18(12)23-8-4-7-16(11-23)20-13(2)24/h3,5-6,9-10,16H,4,7-8,11H2,1-2H3,(H,20,24).
What are the key properties of N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide?
N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide has a molecular weight of 328.39 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide is sourced from PubChem (CID 71862457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).