3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide

C16H22N2O3 — CID 108943481

IUPAC3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide
SMILESO=C(CC(=O)N1CCOCC1)NCCCc1ccccc1
InChIInChI=1S/C16H22N2O3/c19-15(13-16(20)18-9-11-21-12-10-18)17-8-4-7-14-5-2-1-3-6-14/h1-3,5-6H,4,7-13H2,(H,17,19)
InChIKeyNWXXSPGPAVOFLN-UHFFFAOYSA-N
MW290.36 g/mol
LogP0.98
Rot. Bonds6

About 3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide

3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide (PubChem CID 108943481) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide.

Molecular Properties

Compound Name3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide
PubChem CID108943481
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide
SMILESO=C(CC(=O)N1CCOCC1)NCCCc1ccccc1
InChIInChI=1S/C16H22N2O3/c19-15(13-16(20)18-9-11-21-12-10-18)17-8-4-7-14-5-2-1-3-6-14/h1-3,5-6H,4,7-13H2,(H,17,19)
InChIKeyNWXXSPGPAVOFLN-UHFFFAOYSA-N
XLogP0.98
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

3-oxo-N-(3-phenylpropyl)-3-piperidin-1-ylpropanamide
CID 108942374
3-(4-benzylpiperidin-1-yl)-3-oxo-N-(3-phenylpropyl)propanamide
CID 108951179
4-(morpholine-4-carbonyl)-N-(3-phenylpropyl)benzamide
CID 109045457
2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-N-(2-phenylethyl)acetamide
CID 30653596
N-(3-morpholin-4-yl-3-oxopropyl)-2-phenylacetamide
CID 29418767
1-morpholin-4-yl-3-phenylpropan-1-one
CID 532825
3-(4-methylpiperazin-1-yl)-3-oxo-N-(2-phenylethyl)propanamide
CID 108944340
6-(morpholine-4-carbonyl)-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 109096025
1-morpholin-4-yl-2-[4-(3-phenylpropyl)piperazin-1-yl]ethanone
CID 47014088
3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxo-N-(2-phenylethyl)propanamide
CID 108947922
3-morpholin-4-yl-N-(2-phenylethyl)propanamide
CID 779164
1-(1,4-diphenylbutyl)-3-(3-morpholin-4-yl-3-oxopropyl)urea
CID 47048242

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide?
The IUPAC name of 3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide (CID 108943481) is 3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide.
What is the SMILES notation for 3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide?
The canonical SMILES for 3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide is O=C(CC(=O)N1CCOCC1)NCCCc1ccccc1.
What is the InChIKey of 3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide?
The InChIKey is NWXXSPGPAVOFLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c19-15(13-16(20)18-9-11-21-12-10-18)17-8-4-7-14-5-2-1-3-6-14/h1-3,5-6H,4,7-13H2,(H,17,19).
What are the key properties of 3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide?
3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide has a molecular weight of 290.36 g/mol, XLogP of 0.98, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-3-oxo-N-(3-phenylpropyl)propanamide is sourced from PubChem (CID 108943481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).