N-(4-ethenoxybutyl)formamide

C7H13NO2 — CID 15193672

IUPACN-(4-ethenoxybutyl)formamide
SMILESC=COCCCCNC=O
InChIInChI=1S/C7H13NO2/c1-2-10-6-4-3-5-8-7-9/h2,7H,1,3-6H2,(H,8,9)
InChIKeyCBPSPTRAOZZXLM-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.67
Rot. Bonds7

About N-(4-ethenoxybutyl)formamide

N-(4-ethenoxybutyl)formamide (PubChem CID 15193672) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is N-(4-ethenoxybutyl)formamide.

Molecular Properties

Compound NameN-(4-ethenoxybutyl)formamide
PubChem CID15193672
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC NameN-(4-ethenoxybutyl)formamide
SMILESC=COCCCCNC=O
InChIInChI=1S/C7H13NO2/c1-2-10-6-4-3-5-8-7-9/h2,7H,1,3-6H2,(H,8,9)
InChIKeyCBPSPTRAOZZXLM-UHFFFAOYSA-N
XLogP0.67
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethenoxybutyl)formamide?
The IUPAC name of N-(4-ethenoxybutyl)formamide (CID 15193672) is N-(4-ethenoxybutyl)formamide.
What is the SMILES notation for N-(4-ethenoxybutyl)formamide?
The canonical SMILES for N-(4-ethenoxybutyl)formamide is C=COCCCCNC=O.
What is the InChIKey of N-(4-ethenoxybutyl)formamide?
The InChIKey is CBPSPTRAOZZXLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-2-10-6-4-3-5-8-7-9/h2,7H,1,3-6H2,(H,8,9).
What are the key properties of N-(4-ethenoxybutyl)formamide?
N-(4-ethenoxybutyl)formamide has a molecular weight of 143.19 g/mol, XLogP of 0.67, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethenoxybutyl)formamide is sourced from PubChem (CID 15193672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).