N-(3-ethenoxypropyl)formamide

C6H11NO2 — CID 15193671

IUPACN-(3-ethenoxypropyl)formamide
SMILESC=COCCCNC=O
InChIInChI=1S/C6H11NO2/c1-2-9-5-3-4-7-6-8/h2,6H,1,3-5H2,(H,7,8)
InChIKeyBOQJDAXNZFXXMU-UHFFFAOYSA-N
MW129.16 g/mol
LogP0.28
Rot. Bonds6

About N-(3-ethenoxypropyl)formamide

N-(3-ethenoxypropyl)formamide (PubChem CID 15193671) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is N-(3-ethenoxypropyl)formamide.

Molecular Properties

Compound NameN-(3-ethenoxypropyl)formamide
PubChem CID15193671
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC NameN-(3-ethenoxypropyl)formamide
SMILESC=COCCCNC=O
InChIInChI=1S/C6H11NO2/c1-2-9-5-3-4-7-6-8/h2,6H,1,3-5H2,(H,7,8)
InChIKeyBOQJDAXNZFXXMU-UHFFFAOYSA-N
XLogP0.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 50.28
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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Related Compounds

N-(3-Methoxypropyl)formamide
CID 349252
N-(2-ethenoxyethyl)formamide
CID 350466
N-(3-propoxypropyl)formamide
CID 53708479
N-(3-ethoxypropyl)formamide
CID 54020778
ethenyl N-propylcarbamate
CID 54140582
3-Ethenoxypropylurea
CID 55288672
N-(3-methoxypropyl)-1-tritioformamide
CID 57647983
N-(3-ethenoxypropyl)acetamide
CID 60707351
Ethenyl 3-formamidopropanoate
CID 88371080
N-(1-ethenoxyethyl)formamide
CID 88809766
ethenyl N-(3-methoxypropyl)carbamate
CID 156869207
N-(4-ethenoxybutyl)formamide
CID 15193672

Frequently Asked Questions

What is the IUPAC name of N-(3-ethenoxypropyl)formamide?
The IUPAC name of N-(3-ethenoxypropyl)formamide (CID 15193671) is N-(3-ethenoxypropyl)formamide.
What is the SMILES notation for N-(3-ethenoxypropyl)formamide?
The canonical SMILES for N-(3-ethenoxypropyl)formamide is C=COCCCNC=O.
What is the InChIKey of N-(3-ethenoxypropyl)formamide?
The InChIKey is BOQJDAXNZFXXMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-2-9-5-3-4-7-6-8/h2,6H,1,3-5H2,(H,7,8).
What are the key properties of N-(3-ethenoxypropyl)formamide?
N-(3-ethenoxypropyl)formamide has a molecular weight of 129.16 g/mol, XLogP of 0.28, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethenoxypropyl)formamide is sourced from PubChem (CID 15193671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).