N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide

C15H22IN3O — CID 106635710

IUPACN-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
SMILESCN(CC(=O)Nc1cccc(I)c1)CC1CCCCN1
InChIInChI=1S/C15H22IN3O/c1-19(10-14-6-2-3-8-17-14)11-15(20)18-13-7-4-5-12(16)9-13/h4-5,7,9,14,17H,2-3,6,8,10-11H2,1H3,(H,18,20)
InChIKeyQYVSLHZQYZNUQD-UHFFFAOYSA-N
MW387.27 g/mol
LogP2.30
Rot. Bonds5

About N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide

N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide (PubChem CID 106635710) has the molecular formula C15H22IN3O and a molecular weight of 387.27 g/mol. Its IUPAC name is N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
PubChem CID106635710
Molecular FormulaC15H22IN3O
Molecular Weight387.27 g/mol
Exact Mass387.08
IUPAC NameN-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
SMILESCN(CC(=O)Nc1cccc(I)c1)CC1CCCCN1
InChIInChI=1S/C15H22IN3O/c1-19(10-14-6-2-3-8-17-14)11-15(20)18-13-7-4-5-12(16)9-13/h4-5,7,9,14,17H,2-3,6,8,10-11H2,1H3,(H,18,20)
InChIKeyQYVSLHZQYZNUQD-UHFFFAOYSA-N
XLogP2.30
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.27
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-iodophenyl)-2-[methyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614250
2-[ethyl(piperidin-2-ylmethyl)amino]-N-(3-iodophenyl)acetamide
CID 106632733
N-(3-ethylphenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
CID 106635534
N-(3-methoxyphenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
CID 106635727
N-(4-iodo-2-methylphenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
CID 106635701
N-(3-methylphenyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide
CID 66273632
2-[methyl(piperidin-2-ylmethyl)amino]-N-pyrimidin-2-ylacetamide
CID 106635732
N-(4-iodo-2-methylphenyl)-2-[methyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614241
N-(2,5-difluorophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
CID 106635385
N-(4-bromo-2-methylphenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide
CID 106635384
N-(3-acetamidophenyl)-2-piperidin-2-ylacetamide
CID 43151365
2-[methyl(pyrrolidin-2-ylmethyl)amino]-N-(2,4,6-trichlorophenyl)acetamide
CID 106613623

Frequently Asked Questions

What is the IUPAC name of N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide?
The IUPAC name of N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide (CID 106635710) is N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide.
What is the SMILES notation for N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide?
The canonical SMILES for N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide is CN(CC(=O)Nc1cccc(I)c1)CC1CCCCN1.
What is the InChIKey of N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide?
The InChIKey is QYVSLHZQYZNUQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22IN3O/c1-19(10-14-6-2-3-8-17-14)11-15(20)18-13-7-4-5-12(16)9-13/h4-5,7,9,14,17H,2-3,6,8,10-11H2,1H3,(H,18,20).
What are the key properties of N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide?
N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide has a molecular weight of 387.27 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-iodophenyl)-2-[methyl(piperidin-2-ylmethyl)amino]acetamide is sourced from PubChem (CID 106635710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).