(2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide

C19H26N4O4 — CID 41037007

IUPAC(2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide
SMILESCCC[C@H]1NC(=O)N([C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)C1=O
InChIInChI=1S/C19H26N4O4/c1-3-4-16-18(25)23(19(26)21-16)13(2)17(24)20-14-5-7-15(8-6-14)22-9-11-27-12-10-22/h5-8,13,16H,3-4,9-12H2,1-2H3,(H,20,24)(H,21,26)/t13-,16-/m1/s1
InChIKeyXZULMLNRPGSUKN-CZUORRHYSA-N
MW374.44 g/mol
LogP1.57
Rot. Bonds6

About (2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide

(2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide (PubChem CID 41037007) has the molecular formula C19H26N4O4 and a molecular weight of 374.44 g/mol. Its IUPAC name is (2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide
PubChem CID41037007
Molecular FormulaC19H26N4O4
Molecular Weight374.44 g/mol
Exact Mass374.20
IUPAC Name(2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide
SMILESCCC[C@H]1NC(=O)N([C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)C1=O
InChIInChI=1S/C19H26N4O4/c1-3-4-16-18(25)23(19(26)21-16)13(2)17(24)20-14-5-7-15(8-6-14)22-9-11-27-12-10-22/h5-8,13,16H,3-4,9-12H2,1-2H3,(H,20,24)(H,21,26)/t13-,16-/m1/s1
InChIKeyXZULMLNRPGSUKN-CZUORRHYSA-N
XLogP1.57
TPSA90.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-[(4S)-4-butyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide
CID 9295432
(2S)-2-[(4R)-4-hexyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide
CID 9329126
(2R)-2-[(4R)-4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide
CID 41190610
2-amino-N-(4-morpholin-4-ylphenyl)propanamide
CID 60638930
(2S,3S)-2-amino-3-methyl-N-(4-morpholin-4-ylphenyl)pentanamide
CID 58441866
(2S)-2-(cyclohexylamino)-N-(4-morpholin-4-ylphenyl)propanamide
CID 7928372
(2S)-2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]-N-(4-morpholin-4-ylphenyl)propanamide
CID 9030106
3-hydroxypropyl-[(2S)-1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl]azanium
CID 7998281
(2R)-2-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(4-piperidin-1-ylphenyl)propanamide
CID 129419276
1-(4-morpholin-4-ylphenyl)-3-propylurea
CID 2788991
N-(4-morpholin-4-ylphenyl)pentanamide
CID 2765048
(2R)-2-acetamido-3-methyl-N-(4-morpholin-4-ylphenyl)butanamide
CID 41236080

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide?
The IUPAC name of (2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide (CID 41037007) is (2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide.
What is the SMILES notation for (2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide?
The canonical SMILES for (2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide is CCC[C@H]1NC(=O)N([C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)C1=O.
What is the InChIKey of (2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide?
The InChIKey is XZULMLNRPGSUKN-CZUORRHYSA-N. The full InChI is InChI=1S/C19H26N4O4/c1-3-4-16-18(25)23(19(26)21-16)13(2)17(24)20-14-5-7-15(8-6-14)22-9-11-27-12-10-22/h5-8,13,16H,3-4,9-12H2,1-2H3,(H,20,24)(H,21,26)/t13-,16-/m1/s1.
What are the key properties of (2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide?
(2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide has a molecular weight of 374.44 g/mol, XLogP of 1.57, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(4R)-2,5-dioxo-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide is sourced from PubChem (CID 41037007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).