N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide

C16H21N3O3 — CID 119724536

IUPACN-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide
SMILESO=C(Nc1cccc(N2CCCCC2=O)c1)C1CNCCO1
InChIInChI=1S/C16H21N3O3/c20-15-6-1-2-8-19(15)13-5-3-4-12(10-13)18-16(21)14-11-17-7-9-22-14/h3-5,10,14,17H,1-2,6-9,11H2,(H,18,21)
InChIKeyIDLGWHRHZWPNAE-UHFFFAOYSA-N
MW303.36 g/mol
LogP1.13
Rot. Bonds3

About N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide

N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide (PubChem CID 119724536) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide
PubChem CID119724536
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC NameN-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide
SMILESO=C(Nc1cccc(N2CCCCC2=O)c1)C1CNCCO1
InChIInChI=1S/C16H21N3O3/c20-15-6-1-2-8-19(15)13-5-3-4-12(10-13)18-16(21)14-11-17-7-9-22-14/h3-5,10,14,17H,1-2,6-9,11H2,(H,18,21)
InChIKeyIDLGWHRHZWPNAE-UHFFFAOYSA-N
XLogP1.13
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,3S)-2-methyl-N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-3-carboxamide
CID 120924428
N-[3-(2-oxopiperidin-1-yl)phenyl]cyclopentanecarboxamide
CID 7687609
N-[3-(2-oxopiperidin-1-yl)phenyl]pyrrolidine-2-carboxamide
CID 119289998
cis-(1R,2S)-2-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]cyclopropane-1-carboxamide
CID 51462133
N-[3-(carbamoylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119702027
N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119273024
N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-2-carboxamide
CID 119713878
(2S)-N-[3-(2,6-dioxo-1,3-diazinan-1-yl)phenyl]oxolane-2-carboxamide
CID 100713681
(2S,5R)-5-(aminomethyl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]oxolane-2-carboxamide;hydrochloride
CID 120784633
N-[3-(morpholine-4-carbonyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119712346
N-[1-[4-(2-oxopyrrolidin-1-yl)phenyl]ethyl]morpholine-2-carboxamide;hydrochloride
CID 119755952
N-[3-(2-oxopyrrolidin-1-yl)phenyl]adamantane-2-carboxamide
CID 51213619

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide?
The IUPAC name of N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide (CID 119724536) is N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide.
What is the SMILES notation for N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide?
The canonical SMILES for N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide is O=C(Nc1cccc(N2CCCCC2=O)c1)C1CNCCO1.
What is the InChIKey of N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide?
The InChIKey is IDLGWHRHZWPNAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3/c20-15-6-1-2-8-19(15)13-5-3-4-12(10-13)18-16(21)14-11-17-7-9-22-14/h3-5,10,14,17H,1-2,6-9,11H2,(H,18,21).
What are the key properties of N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide?
N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide has a molecular weight of 303.36 g/mol, XLogP of 1.13, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-oxopiperidin-1-yl)phenyl]morpholine-2-carboxamide is sourced from PubChem (CID 119724536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).