N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide

C22H28N4O3 — CID 110625276

IUPACN-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide
SMILESO=C(CNC(=O)C(Cc1ccncc1)c1ccccc1)NCCN1CCOCC1
InChIInChI=1S/C22H28N4O3/c27-21(24-10-11-26-12-14-29-15-13-26)17-25-22(28)20(19-4-2-1-3-5-19)16-18-6-8-23-9-7-18/h1-9,20H,10-17H2,(H,24,27)(H,25,28)
InChIKeyHRGWEPOUIXJSCS-UHFFFAOYSA-N
MW396.49 g/mol
LogP0.97
Rot. Bonds9

About N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide

N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide (PubChem CID 110625276) has the molecular formula C22H28N4O3 and a molecular weight of 396.49 g/mol. Its IUPAC name is N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide.

Molecular Properties

Compound NameN-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide
PubChem CID110625276
Molecular FormulaC22H28N4O3
Molecular Weight396.49 g/mol
Exact Mass396.22
IUPAC NameN-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide
SMILESO=C(CNC(=O)C(Cc1ccncc1)c1ccccc1)NCCN1CCOCC1
InChIInChI=1S/C22H28N4O3/c27-21(24-10-11-26-12-14-29-15-13-26)17-25-22(28)20(19-4-2-1-3-5-19)16-18-6-8-23-9-7-18/h1-9,20H,10-17H2,(H,24,27)(H,25,28)
InChIKeyHRGWEPOUIXJSCS-UHFFFAOYSA-N
XLogP0.97
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.49
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-3-phenylpropanamide
CID 110355487
3-(4-fluorophenyl)-2-methyl-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]propanamide
CID 110305497
N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide
CID 110620139
(2S)-3-(4-hydroxyphenyl)-2-phenyl-N-(2-piperidin-1-ylethyl)propanamide
CID 97445107
2-amino-N-(2-morpholin-4-ylethyl)-2-phenylacetamide;dihydrochloride
CID 119827759
2-(2-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]acetamide
CID 112991530
N-(3-morpholin-4-ylphenyl)-2-phenyl-3-pyridin-4-ylpropanamide
CID 110612953
(2R)-N-(2-morpholin-4-ylethyl)-3-phenyl-2-pyrrol-1-ylpropanamide
CID 110205726
2-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-3-thiophen-2-ylpropanamide
CID 110296595
2-[acetyl(pyridin-4-ylmethyl)amino]-N-(2-morpholin-4-ylethyl)acetamide
CID 113163762
3-methyl-N-[(1S)-2-(2-morpholin-4-ylethylamino)-2-oxo-1-phenylethyl]butanamide
CID 95140730
3-methyl-N-[(1R)-2-(2-morpholin-4-ylethylamino)-2-oxo-1-phenylethyl]butanamide
CID 95140732

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide?
The IUPAC name of N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide (CID 110625276) is N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide.
What is the SMILES notation for N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide?
The canonical SMILES for N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide is O=C(CNC(=O)C(Cc1ccncc1)c1ccccc1)NCCN1CCOCC1.
What is the InChIKey of N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide?
The InChIKey is HRGWEPOUIXJSCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O3/c27-21(24-10-11-26-12-14-29-15-13-26)17-25-22(28)20(19-4-2-1-3-5-19)16-18-6-8-23-9-7-18/h1-9,20H,10-17H2,(H,24,27)(H,25,28).
What are the key properties of N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide?
N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide has a molecular weight of 396.49 g/mol, XLogP of 0.97, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide is sourced from PubChem (CID 110625276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).