2-(2-iodocyclopentyl)-N-methylacetamide

C8H14INO — CID 147349767

IUPAC2-(2-iodocyclopentyl)-N-methylacetamide
SMILESCNC(=O)CC1CCCC1I
InChIInChI=1S/C8H14INO/c1-10-8(11)5-6-3-2-4-7(6)9/h6-7H,2-5H2,1H3,(H,10,11)
InChIKeyDFDORCIJQONPKO-UHFFFAOYSA-N
MW267.11 g/mol
LogP1.73
Rot. Bonds2

About 2-(2-iodocyclopentyl)-N-methylacetamide

2-(2-iodocyclopentyl)-N-methylacetamide (PubChem CID 147349767) has the molecular formula C8H14INO and a molecular weight of 267.11 g/mol. Its IUPAC name is 2-(2-iodocyclopentyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(2-iodocyclopentyl)-N-methylacetamide
PubChem CID147349767
Molecular FormulaC8H14INO
Molecular Weight267.11 g/mol
Exact Mass267.01
IUPAC Name2-(2-iodocyclopentyl)-N-methylacetamide
SMILESCNC(=O)CC1CCCC1I
InChIInChI=1S/C8H14INO/c1-10-8(11)5-6-3-2-4-7(6)9/h6-7H,2-5H2,1H3,(H,10,11)
InChIKeyDFDORCIJQONPKO-UHFFFAOYSA-N
XLogP1.73
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.11
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-cyclobutyl-N-methylacetamide
CID 57296172
1-[(1S,2S)-2-iodocyclopentyl]-3-methylurea
CID 138652029
N-[[(1S)-2-iodocyclopentyl]methylsulfanyl]methanamine
CID 171766476
N-methyl-2-[(2R)-pyrrolidin-2-yl]acetamide
CID 66776546
2-[(1S,2R)-2-aminocyclopentyl]-N-ethylacetamide
CID 130759051
N-methyl-2-[(2S)-pyrrolidin-2-yl]acetamide
CID 66778094
N-methyl-4-[(2-methylcyclopentyl)methylamino]butanamide
CID 107417872
[(2E)-8-[2-(methylamino)-2-oxoethyl]cyclooct-2-en-1-yl] N-ethylcarbamate
CID 90184401
2-(cyclooctylmethylamino)-N-methylacetamide
CID 134293833
N-methyl-4-[2-(methylamino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 155198720
2-(2,6-dimethylpiperidin-1-yl)-N-methylacetamide
CID 59404509
2-(aminomethyl)-N-methyl-N-[3-(methylamino)-3-oxopropyl]cyclopentane-1-carboxamide
CID 103822190

Frequently Asked Questions

What is the IUPAC name of 2-(2-iodocyclopentyl)-N-methylacetamide?
The IUPAC name of 2-(2-iodocyclopentyl)-N-methylacetamide (CID 147349767) is 2-(2-iodocyclopentyl)-N-methylacetamide.
What is the SMILES notation for 2-(2-iodocyclopentyl)-N-methylacetamide?
The canonical SMILES for 2-(2-iodocyclopentyl)-N-methylacetamide is CNC(=O)CC1CCCC1I.
What is the InChIKey of 2-(2-iodocyclopentyl)-N-methylacetamide?
The InChIKey is DFDORCIJQONPKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14INO/c1-10-8(11)5-6-3-2-4-7(6)9/h6-7H,2-5H2,1H3,(H,10,11).
What are the key properties of 2-(2-iodocyclopentyl)-N-methylacetamide?
2-(2-iodocyclopentyl)-N-methylacetamide has a molecular weight of 267.11 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-iodocyclopentyl)-N-methylacetamide is sourced from PubChem (CID 147349767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).