3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile

C16H20N4O2 — CID 155974260

IUPAC3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile
SMILESN#Cc1ncccc1N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C16H20N4O2/c17-11-14-15(4-1-5-18-14)20-6-2-3-13(12-20)16(21)19-7-9-22-10-8-19/h1,4-5,13H,2-3,6-10,12H2
InChIKeyGPECTGYSIONSFX-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.03
Rot. Bonds2

About 3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile

3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile (PubChem CID 155974260) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile.

Molecular Properties

Compound Name3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile
PubChem CID155974260
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile
SMILESN#Cc1ncccc1N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C16H20N4O2/c17-11-14-15(4-1-5-18-14)20-6-2-3-13(12-20)16(21)19-7-9-22-10-8-19/h1,4-5,13H,2-3,6-10,12H2
InChIKeyGPECTGYSIONSFX-UHFFFAOYSA-N
XLogP1.03
TPSA69.46 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-fluoro-6-[3-(morpholine-4-carbonyl)piperidin-1-yl]benzonitrile
CID 47018174
morpholin-4-yl-[(3R)-1-(3-nitro-2-pyridinyl)piperidin-3-yl]methanone
CID 51532486
[1-(3-methylimidazo[4,5-b]pyridin-2-yl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 155976019
morpholin-4-yl-[1-(4-pyridin-3-ylpyrimidin-2-yl)piperidin-3-yl]methanone
CID 72847566
1-(2-cyano-3-pyridinyl)-N-cyclopropylazetidine-3-carboxamide
CID 171326516
2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]pyridine-4-carbonitrile
CID 56879348
N-tert-butyl-1-(2-cyano-3-pyridinyl)pyrrolidine-3-carboxamide
CID 155974197
[1-(2-methylsulfanylpyrimidin-4-yl)piperidin-3-yl]-morpholin-4-ylmethanone
CID 155975861
3-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile
CID 171993509
2-[3-(piperidine-1-carbonyl)pyrrolidin-1-yl]pyridine-3-carbonitrile
CID 166602458
morpholin-4-yl-[1-[6-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]methanone
CID 155975820
morpholin-4-yl-[1-(2-propan-2-ylsulfanylpyridine-3-carbonyl)piperidin-3-yl]methanone
CID 47040772

Frequently Asked Questions

What is the IUPAC name of 3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile?
The IUPAC name of 3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile (CID 155974260) is 3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile.
What is the SMILES notation for 3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile?
The canonical SMILES for 3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile is N#Cc1ncccc1N1CCCC(C(=O)N2CCOCC2)C1.
What is the InChIKey of 3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile?
The InChIKey is GPECTGYSIONSFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c17-11-14-15(4-1-5-18-14)20-6-2-3-13(12-20)16(21)19-7-9-22-10-8-19/h1,4-5,13H,2-3,6-10,12H2.
What are the key properties of 3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile?
3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile has a molecular weight of 300.36 g/mol, XLogP of 1.03, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(morpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile is sourced from PubChem (CID 155974260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).