5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide

C18H26ClN3O2 — CID 133356557

IUPAC5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide
SMILESCCOC1CC(N(C)c2ncc(C(N)=O)cc2Cl)C12CCCCC2
InChIInChI=1S/C18H26ClN3O2/c1-3-24-15-10-14(18(15)7-5-4-6-8-18)22(2)17-13(19)9-12(11-21-17)16(20)23/h9,11,14-15H,3-8,10H2,1-2H3,(H2,20,23)
InChIKeyKQFBKTASZAFOHG-UHFFFAOYSA-N
MW351.88 g/mol
LogP3.40
Rot. Bonds5

About 5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide

5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide (PubChem CID 133356557) has the molecular formula C18H26ClN3O2 and a molecular weight of 351.88 g/mol. Its IUPAC name is 5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide
PubChem CID133356557
Molecular FormulaC18H26ClN3O2
Molecular Weight351.88 g/mol
Exact Mass351.17
IUPAC Name5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide
SMILESCCOC1CC(N(C)c2ncc(C(N)=O)cc2Cl)C12CCCCC2
InChIInChI=1S/C18H26ClN3O2/c1-3-24-15-10-14(18(15)7-5-4-6-8-18)22(2)17-13(19)9-12(11-21-17)16(20)23/h9,11,14-15H,3-8,10H2,1-2H3,(H2,20,23)
InChIKeyKQFBKTASZAFOHG-UHFFFAOYSA-N
XLogP3.40
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.88
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-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

5-chloro-6-[[(1R,3S)-3-ethoxyspiro[3.3]heptan-1-yl]-methylamino]pyridine-3-carboxamide
CID 99700115
3-chloro-2-N-[(1S,3R)-3-ethoxyspiro[3.4]octan-1-yl]-2-N-methylpyridine-2,5-dicarboxamide
CID 97100622
5-chloro-6-[cyclopentylmethyl(methyl)amino]pyridine-3-carboxamide
CID 75418381
N-(3-ethoxyspiro[3.5]nonan-1-yl)-N,6-dimethylpyrimidin-4-amine
CID 133356876
4,5-dichloro-N-[(1R,3S)-3-ethoxyspiro[3.4]octan-1-yl]-N-methyl-1H-pyrrole-2-carboxamide
CID 99810417
3-chloro-N-[(1S,3R)-3-ethoxy-2,2-dimethylcyclobutyl]-N-methyl-5-nitropyridin-2-amine
CID 99810442
5-chloro-6-ethoxy-N-[(1S,3R)-3-ethoxyspiro[3.4]octan-1-yl]pyridine-3-carboxamide
CID 95782529
2-amino-N-(3-ethoxyspiro[3.5]nonan-1-yl)-N-methylacetamide
CID 119335015
(1S,3S)-3-ethoxy-1-[methyl(sulfamoyl)amino]spiro[3.5]nonane
CID 99774644
6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carbonitrile
CID 133356894
6-chloro-3-[(3-ethoxyspiro[3.4]octan-1-yl)amino]pyridazine-4-carboxamide
CID 133341301
4-(aminomethyl)-N-[(1R,3S)-3-ethoxyspiro[3.4]octan-1-yl]-N-methylbenzamide
CID 124683871

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide (CID 133356557) is 5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide is CCOC1CC(N(C)c2ncc(C(N)=O)cc2Cl)C12CCCCC2.
What is the InChIKey of 5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide?
The InChIKey is KQFBKTASZAFOHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26ClN3O2/c1-3-24-15-10-14(18(15)7-5-4-6-8-18)22(2)17-13(19)9-12(11-21-17)16(20)23/h9,11,14-15H,3-8,10H2,1-2H3,(H2,20,23).
What are the key properties of 5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide?
5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide has a molecular weight of 351.88 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[(3-ethoxyspiro[3.5]nonan-1-yl)-methylamino]pyridine-3-carboxamide is sourced from PubChem (CID 133356557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).