N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide

C18H24IN3O3 — CID 55355785

IUPACN-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(C(=O)N2CCOCC2)CC1)Nc1ccc(I)cc1
InChIInChI=1S/C18H24IN3O3/c19-15-1-3-16(4-2-15)20-17(23)13-21-7-5-14(6-8-21)18(24)22-9-11-25-12-10-22/h1-4,14H,5-13H2,(H,20,23)
InChIKeyDFCMNELQFSOHIJ-UHFFFAOYSA-N
MW457.31 g/mol
LogP1.80
Rot. Bonds4

About N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide

N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide (PubChem CID 55355785) has the molecular formula C18H24IN3O3 and a molecular weight of 457.31 g/mol. Its IUPAC name is N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
PubChem CID55355785
Molecular FormulaC18H24IN3O3
Molecular Weight457.31 g/mol
Exact Mass457.09
IUPAC NameN-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(C(=O)N2CCOCC2)CC1)Nc1ccc(I)cc1
InChIInChI=1S/C18H24IN3O3/c19-15-1-3-16(4-2-15)20-17(23)13-21-7-5-14(6-8-21)18(24)22-9-11-25-12-10-22/h1-4,14H,5-13H2,(H,20,23)
InChIKeyDFCMNELQFSOHIJ-UHFFFAOYSA-N
XLogP1.80
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.31
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-(4-iodophenyl)-2-morpholin-4-ylacetamide
CID 677187
1-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 2400583
N-(4-fluorophenyl)-2-[4-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl]acetamide
CID 16809605
2-[4-(oxane-4-carbonyl)piperazin-1-yl]-N-pyridin-3-ylacetamide
CID 74244540
2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-(thiophen-2-ylmethyl)acetamide
CID 27071147
ethane;N-(4-methylphenyl)-2-morpholin-4-ylacetamide
CID 142923820
N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide
CID 55465968
N-(4-ethynylphenyl)-2-morpholin-4-ylacetamide
CID 46844280
N-(4-fluorophenyl)-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]acetamide
CID 1091485
N-(4-cyclohexylphenyl)-2-morpholin-4-ylacetamide
CID 651814
2-(4-aminopiperidin-1-yl)-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide;dihydrochloride
CID 119908408
N-[4-[(2-chlorophenyl)sulfonylamino]phenyl]-2-morpholin-4-ylacetamide
CID 16623903

Frequently Asked Questions

What is the IUPAC name of N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide (CID 55355785) is N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide is O=C(CN1CCC(C(=O)N2CCOCC2)CC1)Nc1ccc(I)cc1.
What is the InChIKey of N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
The InChIKey is DFCMNELQFSOHIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24IN3O3/c19-15-1-3-16(4-2-15)20-17(23)13-21-7-5-14(6-8-21)18(24)22-9-11-25-12-10-22/h1-4,14H,5-13H2,(H,20,23).
What are the key properties of N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide?
N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide has a molecular weight of 457.31 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodophenyl)-2-[4-(morpholine-4-carbonyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 55355785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).