N-ethenylformamide;hydrochloride

C3H6ClNO — CID 88676818

IUPACN-ethenylformamide;hydrochloride
SMILESC=CNC=O.Cl
InChIInChI=1S/C3H5NO.ClH/c1-2-4-3-5;/h2-3H,1H2,(H,4,5);1H
InChIKeyXQDIGQZDCUFNKV-UHFFFAOYSA-N
MW107.54 g/mol
LogP0.30
Rot. Bonds2

About N-ethenylformamide;hydrochloride

N-ethenylformamide;hydrochloride (PubChem CID 88676818) has the molecular formula C3H6ClNO and a molecular weight of 107.54 g/mol. Its IUPAC name is N-ethenylformamide;hydrochloride.

Molecular Properties

Compound NameN-ethenylformamide;hydrochloride
PubChem CID88676818
Molecular FormulaC3H6ClNO
Molecular Weight107.54 g/mol
Exact Mass107.01
IUPAC NameN-ethenylformamide;hydrochloride
SMILESC=CNC=O.Cl
InChIInChI=1S/C3H5NO.ClH/c1-2-4-3-5;/h2-3H,1H2,(H,4,5);1H
InChIKeyXQDIGQZDCUFNKV-UHFFFAOYSA-N
XLogP0.30
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.54
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethenylformamide;hydrochloride?
The IUPAC name of N-ethenylformamide;hydrochloride (CID 88676818) is N-ethenylformamide;hydrochloride.
What is the SMILES notation for N-ethenylformamide;hydrochloride?
The canonical SMILES for N-ethenylformamide;hydrochloride is C=CNC=O.Cl.
What is the InChIKey of N-ethenylformamide;hydrochloride?
The InChIKey is XQDIGQZDCUFNKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5NO.ClH/c1-2-4-3-5;/h2-3H,1H2,(H,4,5);1H.
What are the key properties of N-ethenylformamide;hydrochloride?
N-ethenylformamide;hydrochloride has a molecular weight of 107.54 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenylformamide;hydrochloride is sourced from PubChem (CID 88676818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).