(3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide

C20H24N2O2 — CID 8005269

IUPAC(3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide
SMILESC[C@@H](CC(=O)Nc1ccccc1N1CCOCC1)c1ccccc1
InChIInChI=1S/C20H24N2O2/c1-16(17-7-3-2-4-8-17)15-20(23)21-18-9-5-6-10-19(18)22-11-13-24-14-12-22/h2-10,16H,11-15H2,1H3,(H,21,23)/t16-/m0/s1
InChIKeyCIWNKCARYHJGSS-INIZCTEOSA-N
MW324.42 g/mol
LogP3.66
Rot. Bonds5

About (3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide

(3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide (PubChem CID 8005269) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is (3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide.

Molecular Properties

Compound Name(3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide
PubChem CID8005269
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name(3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide
SMILESC[C@@H](CC(=O)Nc1ccccc1N1CCOCC1)c1ccccc1
InChIInChI=1S/C20H24N2O2/c1-16(17-7-3-2-4-8-17)15-20(23)21-18-9-5-6-10-19(18)22-11-13-24-14-12-22/h2-10,16H,11-15H2,1H3,(H,21,23)/t16-/m0/s1
InChIKeyCIWNKCARYHJGSS-INIZCTEOSA-N
XLogP3.66
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(ethylamino)-N-(2-morpholin-4-ylphenyl)butanamide
CID 62839891
N-(2-morpholin-4-ylphenyl)-3-oxobutanamide
CID 18071535
2-(4-butan-2-ylphenoxy)-N-(2-morpholin-4-ylphenyl)acetamide
CID 2954143
2-methyl-N-(2-morpholin-4-ylphenyl)propanamide
CID 2767049
2-bromo-N-(2-morpholin-4-ylphenyl)acetamide
CID 60650852
3-(4-fluorophenyl)-N-(2-morpholin-4-ylphenyl)pentanamide
CID 110356139
2-(3-methylbutylamino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 109005860
N-(5-morpholin-4-yl-2-pyridinyl)-3-phenylbutanamide
CID 134053190
2-[acetyl(propan-2-yl)amino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 113158255
N-(2-morpholin-4-ylphenyl)-2-(propan-2-ylcarbamoylamino)acetamide
CID 113000312
2-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]sulfanylacetic acid
CID 2813228
(2S)-2-amino-N-(2-morpholin-4-ylphenyl)-2-phenylacetamide
CID 22691745

Frequently Asked Questions

What is the IUPAC name of (3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide?
The IUPAC name of (3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide (CID 8005269) is (3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide.
What is the SMILES notation for (3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide?
The canonical SMILES for (3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide is C[C@@H](CC(=O)Nc1ccccc1N1CCOCC1)c1ccccc1.
What is the InChIKey of (3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide?
The InChIKey is CIWNKCARYHJGSS-INIZCTEOSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-16(17-7-3-2-4-8-17)15-20(23)21-18-9-5-6-10-19(18)22-11-13-24-14-12-22/h2-10,16H,11-15H2,1H3,(H,21,23)/t16-/m0/s1.
What are the key properties of (3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide?
(3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide has a molecular weight of 324.42 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-(2-morpholin-4-ylphenyl)-3-phenylbutanamide is sourced from PubChem (CID 8005269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).