N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide

C22H26FN3O2 — CID 123587833

IUPACN-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCCC3(CCN(c4cccc(F)c4)C3O)C2)ccn1
InChIInChI=1S/C22H26FN3O2/c1-15-12-16(7-10-24-15)20(27)25-18-5-3-8-22(14-18)9-11-26(21(22)28)19-6-2-4-17(23)13-19/h2,4,6-7,10,12-13,18,21,28H,3,5,8-9,11,14H2,1H3,(H,25,27)
InChIKeyOIOURFLOMQWDNH-UHFFFAOYSA-N
MW383.47 g/mol
LogP3.42
Rot. Bonds3

About N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide

N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide (PubChem CID 123587833) has the molecular formula C22H26FN3O2 and a molecular weight of 383.47 g/mol. Its IUPAC name is N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide
PubChem CID123587833
Molecular FormulaC22H26FN3O2
Molecular Weight383.47 g/mol
Exact Mass383.20
IUPAC NameN-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide
SMILESCc1cc(C(=O)NC2CCCC3(CCN(c4cccc(F)c4)C3O)C2)ccn1
InChIInChI=1S/C22H26FN3O2/c1-15-12-16(7-10-24-15)20(27)25-18-5-3-8-22(14-18)9-11-26(21(22)28)19-6-2-4-17(23)13-19/h2,4,6-7,10,12-13,18,21,28H,3,5,8-9,11,14H2,1H3,(H,25,27)
InChIKeyOIOURFLOMQWDNH-UHFFFAOYSA-N
XLogP3.42
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.47
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide 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

N-[(5S,7S)-2-(3-fluorophenyl)-1-oxo-2-azaspiro[4.5]decan-7-yl]pyridine-4-carboxamide
CID 67108857
2-methyl-N-(5-oxaspiro[3.5]nonan-8-yl)pyridine-4-carboxamide
CID 166234579
2-methyl-N-[(5S,7R)-2-(2-methylpyrimidin-4-yl)-1-oxo-2-azaspiro[4.5]decan-7-yl]pyridine-4-carboxamide
CID 52911567
3-fluoro-N-[(5S,7S)-2-methyl-1-oxo-2-azaspiro[4.5]decan-7-yl]benzamide
CID 67108472
N-[2-(3,5-difluorophenyl)-7-hydroxy-7-methyl-1-oxo-2-azaspiro[4.5]decan-9-yl]-2-methylpyridine-4-carboxamide
CID 141292635
2-methyl-N-(oxolan-3-yl)pyridine-4-carboxamide
CID 139360784
N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpyridine-4-carboxamide
CID 106753486
N-[(5S,7S)-2-[3-(dimethylamino)phenyl]-1-oxo-2-azaspiro[4.5]decan-7-yl]-3-fluorobenzamide
CID 58237136
N-[(5R,7S)-2-(3-fluorophenyl)-1-oxo-2-azaspiro[4.5]decan-7-yl]pyridine-2-carboxamide
CID 58237396
2-methyl-N-(oxetan-3-yl)pyridine-4-carboxamide
CID 106753340
3-fluoro-N-(1-oxo-2-propyl-2-azaspiro[4.5]decan-7-yl)benzamide
CID 67108219
3-methyl-1-[(2-methylpyridine-4-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 106752561

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide?
The IUPAC name of N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide (CID 123587833) is N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide.
What is the SMILES notation for N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide?
The canonical SMILES for N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide is Cc1cc(C(=O)NC2CCCC3(CCN(c4cccc(F)c4)C3O)C2)ccn1.
What is the InChIKey of N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide?
The InChIKey is OIOURFLOMQWDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26FN3O2/c1-15-12-16(7-10-24-15)20(27)25-18-5-3-8-22(14-18)9-11-26(21(22)28)19-6-2-4-17(23)13-19/h2,4,6-7,10,12-13,18,21,28H,3,5,8-9,11,14H2,1H3,(H,25,27).
What are the key properties of N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide?
N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide has a molecular weight of 383.47 g/mol, XLogP of 3.42, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluorophenyl)-1-hydroxy-2-azaspiro[4.5]decan-7-yl]-2-methylpyridine-4-carboxamide is sourced from PubChem (CID 123587833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).