N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide

C20H24N2O2 — CID 2199608

IUPACN-(3-morpholin-4-ylpropyl)-2-phenylbenzamide
SMILESO=C(NCCCN1CCOCC1)c1ccccc1-c1ccccc1
InChIInChI=1S/C20H24N2O2/c23-20(21-11-6-12-22-13-15-24-16-14-22)19-10-5-4-9-18(19)17-7-2-1-3-8-17/h1-5,7-10H,6,11-16H2,(H,21,23)
InChIKeyRHLJKQOSGRQFCG-UHFFFAOYSA-N
MW324.42 g/mol
LogP2.81
Rot. Bonds6

About N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide

N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide (PubChem CID 2199608) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)-2-phenylbenzamide
PubChem CID2199608
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-(3-morpholin-4-ylpropyl)-2-phenylbenzamide
SMILESO=C(NCCCN1CCOCC1)c1ccccc1-c1ccccc1
InChIInChI=1S/C20H24N2O2/c23-20(21-11-6-12-22-13-15-24-16-14-22)19-10-5-4-9-18(19)17-7-2-1-3-8-17/h1-5,7-10H,6,11-16H2,(H,21,23)
InChIKeyRHLJKQOSGRQFCG-UHFFFAOYSA-N
XLogP2.81
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-morpholin-4-ylpropyl)-2-phenylbenzamide?
The IUPAC name of N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide (CID 2199608) is N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide is O=C(NCCCN1CCOCC1)c1ccccc1-c1ccccc1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide?
The InChIKey is RHLJKQOSGRQFCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c23-20(21-11-6-12-22-13-15-24-16-14-22)19-10-5-4-9-18(19)17-7-2-1-3-8-17/h1-5,7-10H,6,11-16H2,(H,21,23).
What are the key properties of N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide?
N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide has a molecular weight of 324.42 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)-2-phenylbenzamide is sourced from PubChem (CID 2199608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).