N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide

C16H23N3O2 — CID 119888738

IUPACN-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide
SMILESO=C(NC1CCCN(c2ccccc2)C1)C1COCCN1
InChIInChI=1S/C16H23N3O2/c20-16(15-12-21-10-8-17-15)18-13-5-4-9-19(11-13)14-6-2-1-3-7-14/h1-3,6-7,13,15,17H,4-5,8-12H2,(H,18,20)
InChIKeyOENGJGDJNVTDMX-UHFFFAOYSA-N
MW289.38 g/mol
LogP0.76
Rot. Bonds3

About N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide

N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide (PubChem CID 119888738) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide
PubChem CID119888738
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide
SMILESO=C(NC1CCCN(c2ccccc2)C1)C1COCCN1
InChIInChI=1S/C16H23N3O2/c20-16(15-12-21-10-8-17-15)18-13-5-4-9-19(11-13)14-6-2-1-3-7-14/h1-3,6-7,13,15,17H,4-5,8-12H2,(H,18,20)
InChIKeyOENGJGDJNVTDMX-UHFFFAOYSA-N
XLogP0.76
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide?
The IUPAC name of N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide (CID 119888738) is N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide.
What is the SMILES notation for N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide?
The canonical SMILES for N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide is O=C(NC1CCCN(c2ccccc2)C1)C1COCCN1.
What is the InChIKey of N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide?
The InChIKey is OENGJGDJNVTDMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c20-16(15-12-21-10-8-17-15)18-13-5-4-9-19(11-13)14-6-2-1-3-7-14/h1-3,6-7,13,15,17H,4-5,8-12H2,(H,18,20).
What are the key properties of N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide?
N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpiperidin-3-yl)morpholine-3-carboxamide is sourced from PubChem (CID 119888738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).