N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide

C14H17IN2O2 — CID 49348956

IUPACN-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(C(=O)c2ccc(I)cc2)CC1
InChIInChI=1S/C14H17IN2O2/c1-10(18)16-13-6-8-17(9-7-13)14(19)11-2-4-12(15)5-3-11/h2-5,13H,6-9H2,1H3,(H,16,18)
InChIKeyVTLKHGZAXDSISZ-UHFFFAOYSA-N
MW372.21 g/mol
LogP2.03
Rot. Bonds2

About N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide

N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide (PubChem CID 49348956) has the molecular formula C14H17IN2O2 and a molecular weight of 372.21 g/mol. Its IUPAC name is N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide
PubChem CID49348956
Molecular FormulaC14H17IN2O2
Molecular Weight372.21 g/mol
Exact Mass372.03
IUPAC NameN-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(C(=O)c2ccc(I)cc2)CC1
InChIInChI=1S/C14H17IN2O2/c1-10(18)16-13-6-8-17(9-7-13)14(19)11-2-4-12(15)5-3-11/h2-5,13H,6-9H2,1H3,(H,16,18)
InChIKeyVTLKHGZAXDSISZ-UHFFFAOYSA-N
XLogP2.03
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.21
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[1-(4-propan-2-ylbenzoyl)piperidin-4-yl]acetamide
CID 49348928
N-[1-(5-iodothiophene-3-carbonyl)piperidin-4-yl]acetamide
CID 113233340
N-[1-(4-pyrimidin-5-ylbenzoyl)piperidin-4-yl]acetamide
CID 134803759
N-[1-(6-oxo-1H-pyridine-3-carbonyl)piperidin-4-yl]acetamide
CID 49348738
N-[1-(4-bromo-3-methylbenzoyl)piperidin-4-yl]acetamide
CID 115770342
N-[1-[4-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]acetamide
CID 134801644
(4-aminopiperidin-1-yl)-(4-iodophenyl)methanone
CID 43556171
N-[1-(3-amino-4-fluorobenzoyl)piperidin-4-yl]acetamide
CID 115738808
N-[1-(3-fluorobenzoyl)piperidin-4-yl]acetamide
CID 49348900
(4-iodophenyl)-[4-(methylaminomethyl)piperidin-1-yl]methanone;hydrochloride
CID 119542556
N-[1-(2-fluoropyridine-4-carbonyl)piperidin-4-yl]acetamide
CID 113228864
[4-(1-bromoethyl)piperidin-1-yl]-(4-iodophenyl)methanone
CID 106839277

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide?
The IUPAC name of N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide (CID 49348956) is N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide?
The canonical SMILES for N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide is CC(=O)NC1CCN(C(=O)c2ccc(I)cc2)CC1.
What is the InChIKey of N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide?
The InChIKey is VTLKHGZAXDSISZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17IN2O2/c1-10(18)16-13-6-8-17(9-7-13)14(19)11-2-4-12(15)5-3-11/h2-5,13H,6-9H2,1H3,(H,16,18).
What are the key properties of N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide?
N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide has a molecular weight of 372.21 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-iodobenzoyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 49348956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).