2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide

C21H25ClN2O2 — CID 110355487

IUPAC2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide
SMILESO=C(NCCN1CCOCC1)C(Cc1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C21H25ClN2O2/c22-19-8-6-18(7-9-19)20(16-17-4-2-1-3-5-17)21(25)23-10-11-24-12-14-26-15-13-24/h1-9,20H,10-16H2,(H,23,25)
InChIKeyBTTIDRXTXZKBBG-UHFFFAOYSA-N
MW372.90 g/mol
LogP3.11
Rot. Bonds7

About 2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide

2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide (PubChem CID 110355487) has the molecular formula C21H25ClN2O2 and a molecular weight of 372.90 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide
PubChem CID110355487
Molecular FormulaC21H25ClN2O2
Molecular Weight372.90 g/mol
Exact Mass372.16
IUPAC Name2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide
SMILESO=C(NCCN1CCOCC1)C(Cc1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C21H25ClN2O2/c22-19-8-6-18(7-9-19)20(16-17-4-2-1-3-5-17)21(25)23-10-11-24-12-14-26-15-13-24/h1-9,20H,10-16H2,(H,23,25)
InChIKeyBTTIDRXTXZKBBG-UHFFFAOYSA-N
XLogP3.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.90
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-chlorophenyl)methyl-propanoylamino]-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide
CID 133214559
N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide
CID 110625276
(2R)-N-(2-morpholin-4-ylethyl)-3-phenyl-2-pyrrol-1-ylpropanamide
CID 110205726
(2S)-2-amino-N-(2-morpholin-4-ylethyl)-4-phenylbutanamide
CID 104983793
2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide
CID 110296595
(2R)-2-[4-(2-methylpropyl)phenyl]-N-(2-morpholin-4-ylethyl)propanamide
CID 121452302
2-amino-N-(2-morpholin-4-ylethyl)-2-phenylacetamide;dihydrochloride
CID 119827759
2-(4-chlorophenoxy)-N-(2-morpholin-4-ylethyl)propanamide
CID 51159478
tert-butyl N-[1-(2-morpholin-4-ylethylamino)-1-oxo-3-phenylpropan-2-yl]carbamate
CID 72811822
2-amino-N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide;dihydrochloride
CID 119867130
3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide
CID 127118554
N-(2-morpholin-4-ylethyl)-2-(4-propan-2-ylphenyl)acetamide
CID 110766797

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide (CID 110355487) is 2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide is O=C(NCCN1CCOCC1)C(Cc1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide?
The InChIKey is BTTIDRXTXZKBBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25ClN2O2/c22-19-8-6-18(7-9-19)20(16-17-4-2-1-3-5-17)21(25)23-10-11-24-12-14-26-15-13-24/h1-9,20H,10-16H2,(H,23,25).
What are the key properties of 2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide?
2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide has a molecular weight of 372.90 g/mol, XLogP of 3.11, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide is sourced from PubChem (CID 110355487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).