N-iodo-2-(4-methylpiperidin-1-yl)acetamide

C8H15IN2O — CID 171081144

IUPACN-iodo-2-(4-methylpiperidin-1-yl)acetamide
SMILESCC1CCN(CC(=O)NI)CC1
InChIInChI=1S/C8H15IN2O/c1-7-2-4-11(5-3-7)6-8(12)10-9/h7H,2-6H2,1H3,(H,10,12)
InChIKeyPKUYMWVHMDIYCI-UHFFFAOYSA-N
MW282.12 g/mol
LogP1.18
Rot. Bonds2

About N-iodo-2-(4-methylpiperidin-1-yl)acetamide

N-iodo-2-(4-methylpiperidin-1-yl)acetamide (PubChem CID 171081144) has the molecular formula C8H15IN2O and a molecular weight of 282.12 g/mol. Its IUPAC name is N-iodo-2-(4-methylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-iodo-2-(4-methylpiperidin-1-yl)acetamide
PubChem CID171081144
Molecular FormulaC8H15IN2O
Molecular Weight282.12 g/mol
Exact Mass282.02
IUPAC NameN-iodo-2-(4-methylpiperidin-1-yl)acetamide
SMILESCC1CCN(CC(=O)NI)CC1
InChIInChI=1S/C8H15IN2O/c1-7-2-4-11(5-3-7)6-8(12)10-9/h7H,2-6H2,1H3,(H,10,12)
InChIKeyPKUYMWVHMDIYCI-UHFFFAOYSA-N
XLogP1.18
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.12
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(4-methylpiperidin-1-yl)acetic acid
CID 3153128
2-(4-methylpiperidin-1-yl)-N-pentylacetamide
CID 108993711
2-(4-methylpiperidin-1-yl)-N-(propan-2-ylcarbamoyl)acetamide
CID 8543273
N-(4-acetamidophenyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 2697828
(2S)-3-methyl-2-[[2-(4-methylpiperidin-1-yl)acetyl]amino]butanoic acid
CID 92919551
N-cyclopropyl-2-[4-[2-(4-methylpiperidin-1-yl)acetyl]piperazin-1-yl]acetamide
CID 78822225
2-(4-methylpiperidin-1-yl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 157336758
N-(cyclohexylcarbamoyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 2655086
3-methyl-1-(4-methylpiperidin-1-yl)butan-2-one
CID 23588199
N-(1,1-dioxothiolan-3-yl)-2-(4-methylpiperidin-1-yl)acetamide
CID 51170868
2-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 108993688
N-iodo-2-piperazin-1-ylacetamide
CID 171526171

Frequently Asked Questions

What is the IUPAC name of N-iodo-2-(4-methylpiperidin-1-yl)acetamide?
The IUPAC name of N-iodo-2-(4-methylpiperidin-1-yl)acetamide (CID 171081144) is N-iodo-2-(4-methylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-iodo-2-(4-methylpiperidin-1-yl)acetamide?
The canonical SMILES for N-iodo-2-(4-methylpiperidin-1-yl)acetamide is CC1CCN(CC(=O)NI)CC1.
What is the InChIKey of N-iodo-2-(4-methylpiperidin-1-yl)acetamide?
The InChIKey is PKUYMWVHMDIYCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15IN2O/c1-7-2-4-11(5-3-7)6-8(12)10-9/h7H,2-6H2,1H3,(H,10,12).
What are the key properties of N-iodo-2-(4-methylpiperidin-1-yl)acetamide?
N-iodo-2-(4-methylpiperidin-1-yl)acetamide has a molecular weight of 282.12 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-iodo-2-(4-methylpiperidin-1-yl)acetamide is sourced from PubChem (CID 171081144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).