N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide

C16H24N2O3 — CID 51080680

IUPACN-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide
SMILESCOCCCNC(=O)CN1CCOC(c2ccccc2)C1
InChIInChI=1S/C16H24N2O3/c1-20-10-5-8-17-16(19)13-18-9-11-21-15(12-18)14-6-3-2-4-7-14/h2-4,6-7,15H,5,8-13H2,1H3,(H,17,19)
InChIKeyXRZYNZNRQVIHAJ-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.21
Rot. Bonds7

About N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide

N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide (PubChem CID 51080680) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide
PubChem CID51080680
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide
SMILESCOCCCNC(=O)CN1CCOC(c2ccccc2)C1
InChIInChI=1S/C16H24N2O3/c1-20-10-5-8-17-16(19)13-18-9-11-21-15(12-18)14-6-3-2-4-7-14/h2-4,6-7,15H,5,8-13H2,1H3,(H,17,19)
InChIKeyXRZYNZNRQVIHAJ-UHFFFAOYSA-N
XLogP1.21
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide?
The IUPAC name of N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide (CID 51080680) is N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide?
The canonical SMILES for N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide is COCCCNC(=O)CN1CCOC(c2ccccc2)C1.
What is the InChIKey of N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide?
The InChIKey is XRZYNZNRQVIHAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-20-10-5-8-17-16(19)13-18-9-11-21-15(12-18)14-6-3-2-4-7-14/h2-4,6-7,15H,5,8-13H2,1H3,(H,17,19).
What are the key properties of N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide?
N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.21, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2-(2-phenylmorpholin-4-yl)acetamide is sourced from PubChem (CID 51080680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).