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

C15H21ClN2O2 — CID 127118554

IUPAC3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide
SMILESO=C(CCc1ccc(Cl)cc1)NCCN1CCOCC1
InChIInChI=1S/C15H21ClN2O2/c16-14-4-1-13(2-5-14)3-6-15(19)17-7-8-18-9-11-20-12-10-18/h1-2,4-5H,3,6-12H2,(H,17,19)
InChIKeyBYRLVORYHQFFAE-UHFFFAOYSA-N
MW296.80 g/mol
LogP1.72
Rot. Bonds6

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

3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide (PubChem CID 127118554) has the molecular formula C15H21ClN2O2 and a molecular weight of 296.80 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide
PubChem CID127118554
Molecular FormulaC15H21ClN2O2
Molecular Weight296.80 g/mol
Exact Mass296.13
IUPAC Name3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide
SMILESO=C(CCc1ccc(Cl)cc1)NCCN1CCOCC1
InChIInChI=1S/C15H21ClN2O2/c16-14-4-1-13(2-5-14)3-6-15(19)17-7-8-18-9-11-20-12-10-18/h1-2,4-5H,3,6-12H2,(H,17,19)
InChIKeyBYRLVORYHQFFAE-UHFFFAOYSA-N
XLogP1.72
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-chlorophenyl)-N-(3-morpholin-4-ylpropyl)propanamide
CID 94549604
3-(4-chlorophenyl)-N-(4-piperidin-1-ylbutyl)propanamide
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3-[4-(dimethylamino)phenyl]-N-(4-morpholin-4-ylbutyl)propanamide
CID 110441108
N-[2-(3-chlorophenyl)ethyl]-3-(2-morpholin-4-ylethylamino)propanamide
CID 109016754
5-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)furan-2-carboxamide
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3-(3-chloro-4-fluoroanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109016616
3-morpholin-4-yl-N-(2-phenylethyl)propanamide
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3-(3-amino-4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)propanamide
CID 39442278
2-(4-hydroxyphenyl)-N-(2-morpholin-4-ylethyl)acetamide
CID 78823248
4-(2-morpholin-4-ylethylamino)-4-oxobutanoyl chloride
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Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide?
The IUPAC name of 3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide (CID 127118554) is 3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide.
What is the SMILES notation for 3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide?
The canonical SMILES for 3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide is O=C(CCc1ccc(Cl)cc1)NCCN1CCOCC1.
What is the InChIKey of 3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide?
The InChIKey is BYRLVORYHQFFAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O2/c16-14-4-1-13(2-5-14)3-6-15(19)17-7-8-18-9-11-20-12-10-18/h1-2,4-5H,3,6-12H2,(H,17,19).
What are the key properties of 3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide?
3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide has a molecular weight of 296.80 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)propanamide is sourced from PubChem (CID 127118554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).