morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone

C16H21N3O3 — CID 31006642

IUPACmorpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone
SMILESO=C(c1ccncc1)N1CCC[C@H](C(=O)N2CCOCC2)C1
InChIInChI=1S/C16H21N3O3/c20-15(13-3-5-17-6-4-13)19-7-1-2-14(12-19)16(21)18-8-10-22-11-9-18/h3-6,14H,1-2,7-12H2/t14-/m0/s1
InChIKeyURBZKZRVADNNBR-AWEZNQCLSA-N
MW303.36 g/mol
LogP0.79
Rot. Bonds2

About morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone

morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone (PubChem CID 31006642) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone
PubChem CID31006642
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC Namemorpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone
SMILESO=C(c1ccncc1)N1CCC[C@H](C(=O)N2CCOCC2)C1
InChIInChI=1S/C16H21N3O3/c20-15(13-3-5-17-6-4-13)19-7-1-2-14(12-19)16(21)18-8-10-22-11-9-18/h3-6,14H,1-2,7-12H2/t14-/m0/s1
InChIKeyURBZKZRVADNNBR-AWEZNQCLSA-N
XLogP0.79
TPSA62.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(4-aminobenzoyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 119700503
morpholin-4-yl-[(3S)-1-[4-(1,2,4-triazol-4-yl)benzoyl]piperidin-3-yl]methanone
CID 124568573
[1-[4-(aminomethyl)benzoyl]piperidin-3-yl]-morpholin-4-ylmethanone;hydrochloride
CID 119277068
[4-(1-aminoethyl)piperidin-1-yl]-[1-(pyridine-4-carbonyl)piperidin-3-yl]methanone
CID 119517024
[1-(1-methylbenzimidazole-5-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 118789278
[1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoyl]piperidin-3-yl]-morpholin-4-ylmethanone
CID 134048335
[(3R)-1-(4-fluorobenzoyl)piperidin-3-yl]-piperidin-1-ylmethanone
CID 936701
[1-(5-methylpyrazine-2-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 42783455
N-methyl-1-(pyridine-4-carbonyl)piperidine-3-carboxamide
CID 110258723
[1-(3-methylfuran-2-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 51329391
(6R)-1,6-dimethyl-4-[(3S)-1-(pyridine-4-carbonyl)piperidine-3-carbonyl]piperazin-2-one
CID 124917954
morpholin-4-yl-[(3S)-1-(3-pyridin-4-ylpropyl)piperidin-3-yl]methanone
CID 97352804

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone?
The IUPAC name of morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone (CID 31006642) is morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone?
The canonical SMILES for morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone is O=C(c1ccncc1)N1CCC[C@H](C(=O)N2CCOCC2)C1.
What is the InChIKey of morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone?
The InChIKey is URBZKZRVADNNBR-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H21N3O3/c20-15(13-3-5-17-6-4-13)19-7-1-2-14(12-19)16(21)18-8-10-22-11-9-18/h3-6,14H,1-2,7-12H2/t14-/m0/s1.
What are the key properties of morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone?
morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone has a molecular weight of 303.36 g/mol, XLogP of 0.79, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[(3S)-1-(pyridine-4-carbonyl)piperidin-3-yl]methanone is sourced from PubChem (CID 31006642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).