N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide

C19H21ClN2O2 — CID 110650035

IUPACN-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide
SMILESO=C(CCc1ccc(N2CCOCC2)cc1)Nc1ccc(Cl)cc1
InChIInChI=1S/C19H21ClN2O2/c20-16-4-6-17(7-5-16)21-19(23)10-3-15-1-8-18(9-2-15)22-11-13-24-14-12-22/h1-2,4-9H,3,10-14H2,(H,21,23)
InChIKeyYDTAEYONWAFHRO-UHFFFAOYSA-N
MW344.84 g/mol
LogP3.75
Rot. Bonds5

About N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide

N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide (PubChem CID 110650035) has the molecular formula C19H21ClN2O2 and a molecular weight of 344.84 g/mol. Its IUPAC name is N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide
PubChem CID110650035
Molecular FormulaC19H21ClN2O2
Molecular Weight344.84 g/mol
Exact Mass344.13
IUPAC NameN-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide
SMILESO=C(CCc1ccc(N2CCOCC2)cc1)Nc1ccc(Cl)cc1
InChIInChI=1S/C19H21ClN2O2/c20-16-4-6-17(7-5-16)21-19(23)10-3-15-1-8-18(9-2-15)22-11-13-24-14-12-22/h1-2,4-9H,3,10-14H2,(H,21,23)
InChIKeyYDTAEYONWAFHRO-UHFFFAOYSA-N
XLogP3.75
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.84
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

N-(4-cyanophenyl)-3-(4-morpholin-4-ylphenyl)propanamide
CID 110651342
N-(3,4-dimethylphenyl)-3-(4-morpholin-4-ylphenyl)propanamide
CID 110649726
3-amino-N-(4-morpholin-4-ylphenyl)propanamide
CID 61252883
N-(4-morpholin-4-ylphenyl)-3-pyridin-3-ylpropanamide
CID 35147983
N-[2-(4-chlorophenyl)ethyl]-2-(4-morpholin-4-ylphenyl)acetamide
CID 110412816
N-(4-morpholin-4-ylphenyl)pentanamide
CID 2765048
N-[(4-morpholin-4-ylphenyl)carbamothioyl]-3-phenylpropanamide
CID 1302093
3-(4-chlorophenyl)sulfanyl-N-[4-(2-morpholin-4-ylethyl)phenyl]propanamide
CID 55905661
1-[(4-chlorophenyl)methyl]-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide
CID 100522699
2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 8593396
methyl 4-(4-morpholin-4-ylanilino)-4-oxobutanoate
CID 51985182
N-cyclopropyl-3-(4-morpholin-4-ylphenyl)propanamide
CID 110647271

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide?
The IUPAC name of N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide (CID 110650035) is N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide.
What is the SMILES notation for N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide?
The canonical SMILES for N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide is O=C(CCc1ccc(N2CCOCC2)cc1)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide?
The InChIKey is YDTAEYONWAFHRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O2/c20-16-4-6-17(7-5-16)21-19(23)10-3-15-1-8-18(9-2-15)22-11-13-24-14-12-22/h1-2,4-9H,3,10-14H2,(H,21,23).
What are the key properties of N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide?
N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide has a molecular weight of 344.84 g/mol, XLogP of 3.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-3-(4-morpholin-4-ylphenyl)propanamide is sourced from PubChem (CID 110650035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).