1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile

C12H19N3O2 — CID 48940006

IUPAC1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile
SMILESN#CC1CCN(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H19N3O2/c13-9-11-1-3-14(4-2-11)10-12(16)15-5-7-17-8-6-15/h11H,1-8,10H2
InChIKeyFGBOLWYFTAEODN-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.08
Rot. Bonds2

About 1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile

1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile (PubChem CID 48940006) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile.

Molecular Properties

Compound Name1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile
PubChem CID48940006
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile
SMILESN#CC1CCN(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H19N3O2/c13-9-11-1-3-14(4-2-11)10-12(16)15-5-7-17-8-6-15/h11H,1-8,10H2
InChIKeyFGBOLWYFTAEODN-UHFFFAOYSA-N
XLogP0.08
TPSA56.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminopiperidin-1-yl)-1-morpholin-4-ylethanone;dihydrochloride
CID 56773516
2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone;hydrochloride
CID 119923636
CID 59303846
CID 59303846
2-[4-(2-methylpropyl)piperidin-1-yl]-1-morpholin-4-ylethanone
CID 145317208
1-(2-morpholin-4-yl-2-oxoethyl)pyrrolidine-3-carboxylic acid
CID 63032240
N-carbamoyl-2-(4-cyanopiperidin-1-yl)acetamide
CID 48940889
3-amino-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]propan-1-one
CID 119840080
1-(4-acetylpiperazin-1-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone
CID 60503697
2-(cyclopropylmethylamino)-1-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]ethanone
CID 119834260
2-(4-tert-butylpiperazin-1-yl)-1-morpholin-4-ylethanone
CID 21061564
3-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]propanoic acid
CID 43396296
1-morpholin-4-yl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)ethanone
CID 55515697

Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile?
The IUPAC name of 1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile (CID 48940006) is 1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile.
What is the SMILES notation for 1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile?
The canonical SMILES for 1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile is N#CC1CCN(CC(=O)N2CCOCC2)CC1.
What is the InChIKey of 1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile?
The InChIKey is FGBOLWYFTAEODN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c13-9-11-1-3-14(4-2-11)10-12(16)15-5-7-17-8-6-15/h11H,1-8,10H2.
What are the key properties of 1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile?
1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile has a molecular weight of 237.30 g/mol, XLogP of 0.08, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carbonitrile is sourced from PubChem (CID 48940006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).