methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate

C18H27N3O3 — CID 167829544

IUPACmethyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate
SMILESCOC(=O)c1nc(N2CCC[C@H](CN3CCOCC3)C2)ccc1C
InChIInChI=1S/C18H27N3O3/c1-14-5-6-16(19-17(14)18(22)23-2)21-7-3-4-15(13-21)12-20-8-10-24-11-9-20/h5-6,15H,3-4,7-13H2,1-2H3/t15-/m1/s1
InChIKeyADZSRPUEKBOVDR-OAHLLOKOSA-N
MW333.43 g/mol
LogP1.73
Rot. Bonds4

About methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate

methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate (PubChem CID 167829544) has the molecular formula C18H27N3O3 and a molecular weight of 333.43 g/mol. Its IUPAC name is methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate.

Molecular Properties

Compound Namemethyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate
PubChem CID167829544
Molecular FormulaC18H27N3O3
Molecular Weight333.43 g/mol
Exact Mass333.21
IUPAC Namemethyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate
SMILESCOC(=O)c1nc(N2CCC[C@H](CN3CCOCC3)C2)ccc1C
InChIInChI=1S/C18H27N3O3/c1-14-5-6-16(19-17(14)18(22)23-2)21-7-3-4-15(13-21)12-20-8-10-24-11-9-20/h5-6,15H,3-4,7-13H2,1-2H3/t15-/m1/s1
InChIKeyADZSRPUEKBOVDR-OAHLLOKOSA-N
XLogP1.73
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate with MolForge

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Related Compounds

methyl 6-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridazine-3-carboxylate
CID 133322299
4-[[1-(6-chloro-2-methylpyrimidin-4-yl)piperidin-3-yl]methyl]morpholine
CID 133302102
2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide
CID 71996494
4-[[(3S)-1-(4-pyrrolidin-1-ylpyrimidin-2-yl)piperidin-3-yl]methyl]morpholine
CID 97318478
4-[[1-(4-pyrrolidin-1-ylpyrimidin-2-yl)piperidin-3-yl]methyl]morpholine
CID 75422646
4-[[1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]morpholine
CID 133322391
4-[[(3R)-1-quinoxalin-2-ylpiperidin-3-yl]methyl]morpholine
CID 95624715
methyl 6-[3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]piperidin-1-yl]pyridazine-3-carboxylate
CID 133279613
methyl 4-[[6-[3-(hydroxymethyl)pyrrolidin-1-yl]-3-methylpyridine-2-carbonyl]amino]-3,5-dimethylbenzoate
CID 86707356
methyl 6-[3-(hydroxymethyl)piperidin-1-yl]pyridazine-3-carboxylate
CID 60979698
6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-3-carbonitrile
CID 95624717
methyl 3-chloro-6-morpholin-4-ylpyridine-2-carboxylate
CID 134159276

Frequently Asked Questions

What is the IUPAC name of methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate?
The IUPAC name of methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate (CID 167829544) is methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate.
What is the SMILES notation for methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate?
The canonical SMILES for methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate is COC(=O)c1nc(N2CCC[C@H](CN3CCOCC3)C2)ccc1C.
What is the InChIKey of methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate?
The InChIKey is ADZSRPUEKBOVDR-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H27N3O3/c1-14-5-6-16(19-17(14)18(22)23-2)21-7-3-4-15(13-21)12-20-8-10-24-11-9-20/h5-6,15H,3-4,7-13H2,1-2H3/t15-/m1/s1.
What are the key properties of methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate?
methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate has a molecular weight of 333.43 g/mol, XLogP of 1.73, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate is sourced from PubChem (CID 167829544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).