N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide

C10H20INO4 — CID 148676433

IUPACN-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide
SMILESCOCCCOCCCCOCC(=O)NI
InChIInChI=1S/C10H20INO4/c1-14-5-4-8-15-6-2-3-7-16-9-10(13)12-11/h2-9H2,1H3,(H,12,13)
InChIKeyNQSVYFGJTFNZQE-UHFFFAOYSA-N
MW345.18 g/mol
LogP1.30
Rot. Bonds11

About N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide

N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide (PubChem CID 148676433) has the molecular formula C10H20INO4 and a molecular weight of 345.18 g/mol. Its IUPAC name is N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide.

Molecular Properties

Compound NameN-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide
PubChem CID148676433
Molecular FormulaC10H20INO4
Molecular Weight345.18 g/mol
Exact Mass345.04
IUPAC NameN-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide
SMILESCOCCCOCCCCOCC(=O)NI
InChIInChI=1S/C10H20INO4/c1-14-5-4-8-15-6-2-3-7-16-9-10(13)12-11/h2-9H2,1H3,(H,12,13)
InChIKeyNQSVYFGJTFNZQE-UHFFFAOYSA-N
XLogP1.30
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.18
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(3-methoxypropoxy)ethoxy]-N-methylacetamide
CID 134579961
N-tert-butyl-2-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]acetamide
CID 138656709
2-[3-(4-methoxybutoxy)propoxy]acetamide
CID 142367848
2-[2-(3-methoxypropoxy)ethoxy]acetic acid
CID 54027919
1-methoxy-3-[2-(3-methoxypropoxy)ethoxy]propan-2-one
CID 107508246
methane;2-[2-(4-methoxybutoxy)ethoxy]-N-methylacetamide;6-(4-methoxybutoxy)-N-methylhexanamide;2-[3-(4-methoxybutoxy)propoxy]-N-methylacetamide;3-[4-(2-methoxyethoxy)butoxy]-N-methylpropanamide;5-[2-(2-methoxyethoxy)ethoxy]-N-methylpentanamide;8-(2-methoxyethoxy)-N-methyloctanamide;2-[5-(2-methoxyethoxy)pentoxy]-N-methylacetamide;4-[3-(2-methoxyethoxy)propoxy]-N-methylbutanamide;2-[2-(5-methoxypentoxy)ethoxy]-N-methylacetamide;5-(5-methoxypentoxy)-N-methylpentanamide;2-[4-(3-methoxypropoxy)butoxy]-N-methylacetamide;7-(3-methoxypropoxy)-N-methylheptanamide
CID 157408835
2-[2-(2-methoxyethoxy)ethoxy]-N-methylacetamide
CID 22961397
2-[3-(2-methoxyethoxy)propoxy]acetic acid
CID 87577722
N-hydroxy-2-[2-(2-methoxyethoxy)ethoxy]acetamide
CID 129081938
2-(4-methoxybutoxy)-N-methylacetamide;4-(4-methoxybutoxy)-N-methylbutanamide;3-(4-methoxybutoxy)-N-methylpropanamide;2-[4-(2-methoxyethoxy)butoxy]-N-methylacetamide;3-[2-(2-methoxyethoxy)ethoxy]-N-methylpropanamide;4-(2-methoxyethoxy)-N-methylbutanamide;6-(2-methoxyethoxy)-N-methylhexanamide;5-(2-methoxyethoxy)-N-methylpentanamide;2-[3-(2-methoxyethoxy)propoxy]-N-methylacetamide;2-(6-methoxyhexoxy)-N-methylacetamide;2-methoxy-N-methylacetamide;7-methoxy-N-methylheptanamide;6-methoxy-N-methylhexanamide;5-methoxy-N-methylpentanamide;2-(5-methoxypentoxy)-N-methylacetamide;3-(5-methoxypentoxy)-N-methylpropanamide;2-[2-(3-methoxypropoxy)ethoxy]-N-methylacetamide;4-(3-methoxypropoxy)-N-methylbutanamide;5-(3-methoxypropoxy)-N-methylpentanamide;3-(3-methoxypropoxy)-N-methylpropanamide
CID 167686196
1-methoxy-3-[3-(3-methoxypropoxy)propoxy]propane
CID 6432627
2-(2-methoxyethoxy)-N-(3-methoxypropyl)acetamide
CID 103601588

Frequently Asked Questions

What is the IUPAC name of N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide?
The IUPAC name of N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide (CID 148676433) is N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide.
What is the SMILES notation for N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide?
The canonical SMILES for N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide is COCCCOCCCCOCC(=O)NI.
What is the InChIKey of N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide?
The InChIKey is NQSVYFGJTFNZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20INO4/c1-14-5-4-8-15-6-2-3-7-16-9-10(13)12-11/h2-9H2,1H3,(H,12,13).
What are the key properties of N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide?
N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide has a molecular weight of 345.18 g/mol, XLogP of 1.30, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-iodo-2-[4-(3-methoxypropoxy)butoxy]acetamide is sourced from PubChem (CID 148676433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).