methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate

C17H24N2O3 — CID 164688341

IUPACmethyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate
SMILESCOC(=O)c1ccc(N2CCC[C@]3(CCC[C@H]3OC)C2)nc1
InChIInChI=1S/C17H24N2O3/c1-21-14-5-3-8-17(14)9-4-10-19(12-17)15-7-6-13(11-18-15)16(20)22-2/h6-7,11,14H,3-5,8-10,12H2,1-2H3/t14-,17-/m1/s1
InChIKeyOBZIHOUFOVLAQZ-RHSMWYFYSA-N
MW304.39 g/mol
LogP2.65
Rot. Bonds3

About methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate

methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate (PubChem CID 164688341) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate
PubChem CID164688341
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Namemethyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate
SMILESCOC(=O)c1ccc(N2CCC[C@]3(CCC[C@H]3OC)C2)nc1
InChIInChI=1S/C17H24N2O3/c1-21-14-5-3-8-17(14)9-4-10-19(12-17)15-7-6-13(11-18-15)16(20)22-2/h6-7,11,14H,3-5,8-10,12H2,1-2H3/t14-,17-/m1/s1
InChIKeyOBZIHOUFOVLAQZ-RHSMWYFYSA-N
XLogP2.65
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate 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

(4R,5R)-4-methoxy-7-pyridin-2-yl-7-azaspiro[4.5]decane
CID 135090113
methyl 6-(2-cyclohexyl-1-oxo-2,9-diazaspiro[4.5]decan-9-yl)pyridine-3-carboxylate
CID 143229607
(6-amino-3-pyridinyl)-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]methanone
CID 164699317
2-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-N,N-dimethylpyridine-3-carboxamide
CID 164690007
2-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-1,3-oxazole-4-carboxylic acid
CID 135099403
methyl 6-[2-(3-hydroxypropyl)-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]pyridine-3-carboxylate
CID 70771539
methyl 6-(1-oxo-1,4-thiazinan-4-yl)pyridine-3-carboxylate
CID 134258128
4-[3-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]propoxy]benzoic acid
CID 135094667
5-fluoro-2-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyrimidin-4-amine
CID 164694367
methyl 6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyridine-3-carboxylate
CID 95543397
methyl 6-[(2R)-2-(trifluoromethyl)morpholin-4-yl]pyridine-3-carboxylate
CID 95543398
methyl 6-[4-(4-ethylcyclohexyl)piperazin-1-yl]pyridine-3-carboxylate
CID 22492996

Frequently Asked Questions

What is the IUPAC name of methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate?
The IUPAC name of methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate (CID 164688341) is methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate.
What is the SMILES notation for methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate?
The canonical SMILES for methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate is COC(=O)c1ccc(N2CCC[C@]3(CCC[C@H]3OC)C2)nc1.
What is the InChIKey of methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate?
The InChIKey is OBZIHOUFOVLAQZ-RHSMWYFYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-21-14-5-3-8-17(14)9-4-10-19(12-17)15-7-6-13(11-18-15)16(20)22-2/h6-7,11,14H,3-5,8-10,12H2,1-2H3/t14-,17-/m1/s1.
What are the key properties of methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate?
methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate has a molecular weight of 304.39 g/mol, XLogP of 2.65, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 6-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]pyridine-3-carboxylate is sourced from PubChem (CID 164688341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).