4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide

C15H25N3O4 — CID 49416925

IUPAC4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide
SMILESCCCC(=O)N1CCCC(C(=O)N2CCOC(C(N)=O)C2)C1
InChIInChI=1S/C15H25N3O4/c1-2-4-13(19)17-6-3-5-11(9-17)15(21)18-7-8-22-12(10-18)14(16)20/h11-12H,2-10H2,1H3,(H2,16,20)
InChIKeyPSOCNCMCRKPTSC-UHFFFAOYSA-N
MW311.38 g/mol
LogP-0.26
Rot. Bonds4

About 4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide

4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide (PubChem CID 49416925) has the molecular formula C15H25N3O4 and a molecular weight of 311.38 g/mol. Its IUPAC name is 4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide.

Molecular Properties

Compound Name4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide
PubChem CID49416925
Molecular FormulaC15H25N3O4
Molecular Weight311.38 g/mol
Exact Mass311.18
IUPAC Name4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide
SMILESCCCC(=O)N1CCCC(C(=O)N2CCOC(C(N)=O)C2)C1
InChIInChI=1S/C15H25N3O4/c1-2-4-13(19)17-6-3-5-11(9-17)15(21)18-7-8-22-12(10-18)14(16)20/h11-12H,2-10H2,1H3,(H2,16,20)
InChIKeyPSOCNCMCRKPTSC-UHFFFAOYSA-N
XLogP-0.26
TPSA92.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-butanoyl-N'-hydroxymorpholine-2-carboximidamide
CID 79680443
1-[3-[3-(methylamino)piperidine-1-carbonyl]piperidin-1-yl]butan-1-one;hydrochloride
CID 119492016
1-[3-[4-(aminomethyl)piperidine-1-carbonyl]piperidin-1-yl]butan-1-one;hydrochloride
CID 119423719
4-(2-aminoacetyl)morpholine-2-carboxamide;hydrochloride
CID 130609413
1-[3-(3-piperazin-1-ylpyrrolidine-1-carbonyl)piperidin-1-yl]butan-1-one
CID 120997252
4-(cyclobutanecarbonyl)morpholine-2-carbothioamide
CID 79674396
1-[3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazine-1-carbonyl]piperidin-1-yl]butan-1-one
CID 55882453
(2S)-1-(1-butanoylpiperidine-3-carbonyl)pyrrolidine-2-carboxylic acid
CID 119365358
N-(2-amino-2-methylpropyl)-1-butanoylpiperidine-3-carboxamide
CID 119629275
1-[3-[4-(1-oxo-1-piperidin-1-ylpropan-2-yl)piperazine-1-carbonyl]piperidin-1-yl]butan-1-one
CID 86890817
1-[(3S)-3-[4-(1H-pyrazol-4-yl)piperidine-1-carbonyl]piperidin-1-yl]butan-1-one
CID 95980745
1-[3-[4-(cyclohexylmethyl)-1,4-diazepane-1-carbonyl]piperidin-1-yl]butan-1-one
CID 55955082

Frequently Asked Questions

What is the IUPAC name of 4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide?
The IUPAC name of 4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide (CID 49416925) is 4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide.
What is the SMILES notation for 4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide?
The canonical SMILES for 4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide is CCCC(=O)N1CCCC(C(=O)N2CCOC(C(N)=O)C2)C1.
What is the InChIKey of 4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide?
The InChIKey is PSOCNCMCRKPTSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O4/c1-2-4-13(19)17-6-3-5-11(9-17)15(21)18-7-8-22-12(10-18)14(16)20/h11-12H,2-10H2,1H3,(H2,16,20).
What are the key properties of 4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide?
4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide has a molecular weight of 311.38 g/mol, XLogP of -0.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-butanoylpiperidine-3-carbonyl)morpholine-2-carboxamide is sourced from PubChem (CID 49416925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).