2-ethoxy-N-(6-iodohexyl)acetamide

C10H20INO2 — CID 107848061

IUPAC2-ethoxy-N-(6-iodohexyl)acetamide
SMILESCCOCC(=O)NCCCCCCI
InChIInChI=1S/C10H20INO2/c1-2-14-9-10(13)12-8-6-4-3-5-7-11/h2-9H2,1H3,(H,12,13)
InChIKeyNICKTSXVWQOLQT-UHFFFAOYSA-N
MW313.18 g/mol
LogP2.13
Rot. Bonds9

About 2-ethoxy-N-(6-iodohexyl)acetamide

2-ethoxy-N-(6-iodohexyl)acetamide (PubChem CID 107848061) has the molecular formula C10H20INO2 and a molecular weight of 313.18 g/mol. Its IUPAC name is 2-ethoxy-N-(6-iodohexyl)acetamide.

Molecular Properties

Compound Name2-ethoxy-N-(6-iodohexyl)acetamide
PubChem CID107848061
Molecular FormulaC10H20INO2
Molecular Weight313.18 g/mol
Exact Mass313.05
IUPAC Name2-ethoxy-N-(6-iodohexyl)acetamide
SMILESCCOCC(=O)NCCCCCCI
InChIInChI=1S/C10H20INO2/c1-2-14-9-10(13)12-8-6-4-3-5-7-11/h2-9H2,1H3,(H,12,13)
InChIKeyNICKTSXVWQOLQT-UHFFFAOYSA-N
XLogP2.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.18
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(5-iodopentyl)-2-propoxyacetamide
CID 107941565
6-[(2-ethoxyacetyl)amino]hexanoic acid
CID 28777004
2-ethoxy-N-(3-hydroxypropyl)acetamide
CID 43419254
2-[2-(7-iodoheptylamino)-2-oxoethoxy]ethyl hypoiodite
CID 130361099
2-ethoxy-N-(3-formamidopropyl)acetamide
CID 155439472
2-ethoxy-N-(5-methylhexyl)acetamide
CID 21019006
2-ethoxy-N-(8-oxodecyl)acetamide;molecular hydrogen
CID 171554520
2-ethoxy-N-[8-(propan-2-ylamino)octyl]acetamide;molecular hydrogen
CID 162749920
N-(6-iodohexyl)butanamide
CID 107848130
N-(3-cyanopropyl)-2-ethoxyacetamide
CID 62668485
N-(4-aminopentyl)-2-ethoxyacetamide
CID 106122279
2-ethoxy-N-[2-[2-[2-[2-[(2-ethoxyacetyl)amino]ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 142043664

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(6-iodohexyl)acetamide?
The IUPAC name of 2-ethoxy-N-(6-iodohexyl)acetamide (CID 107848061) is 2-ethoxy-N-(6-iodohexyl)acetamide.
What is the SMILES notation for 2-ethoxy-N-(6-iodohexyl)acetamide?
The canonical SMILES for 2-ethoxy-N-(6-iodohexyl)acetamide is CCOCC(=O)NCCCCCCI.
What is the InChIKey of 2-ethoxy-N-(6-iodohexyl)acetamide?
The InChIKey is NICKTSXVWQOLQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20INO2/c1-2-14-9-10(13)12-8-6-4-3-5-7-11/h2-9H2,1H3,(H,12,13).
What are the key properties of 2-ethoxy-N-(6-iodohexyl)acetamide?
2-ethoxy-N-(6-iodohexyl)acetamide has a molecular weight of 313.18 g/mol, XLogP of 2.13, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(6-iodohexyl)acetamide is sourced from PubChem (CID 107848061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).