N-ethenyl-N'-(2-hydroxyethyl)methanimidamide

C5H10N2O — CID 90250549

IUPACN-ethenyl-N'-(2-hydroxyethyl)methanimidamide
SMILESC=CN/C=N/CCO
InChIInChI=1S/C5H10N2O/c1-2-6-5-7-3-4-8/h2,5,8H,1,3-4H2,(H,6,7)
InChIKeyYTZZBDWQTNYWFL-UHFFFAOYSA-N
MW114.15 g/mol
LogP-0.26
Rot. Bonds4

About N-ethenyl-N'-(2-hydroxyethyl)methanimidamide

N-ethenyl-N'-(2-hydroxyethyl)methanimidamide (PubChem CID 90250549) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is N-ethenyl-N'-(2-hydroxyethyl)methanimidamide.

Molecular Properties

Compound NameN-ethenyl-N'-(2-hydroxyethyl)methanimidamide
PubChem CID90250549
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC NameN-ethenyl-N'-(2-hydroxyethyl)methanimidamide
SMILESC=CN/C=N/CCO
InChIInChI=1S/C5H10N2O/c1-2-6-5-7-3-4-8/h2,5,8H,1,3-4H2,(H,6,7)
InChIKeyYTZZBDWQTNYWFL-UHFFFAOYSA-N
XLogP-0.26
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N'-(2-hydroxyethyl)methanimidamide?
The IUPAC name of N-ethenyl-N'-(2-hydroxyethyl)methanimidamide (CID 90250549) is N-ethenyl-N'-(2-hydroxyethyl)methanimidamide.
What is the SMILES notation for N-ethenyl-N'-(2-hydroxyethyl)methanimidamide?
The canonical SMILES for N-ethenyl-N'-(2-hydroxyethyl)methanimidamide is C=CN/C=N/CCO.
What is the InChIKey of N-ethenyl-N'-(2-hydroxyethyl)methanimidamide?
The InChIKey is YTZZBDWQTNYWFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O/c1-2-6-5-7-3-4-8/h2,5,8H,1,3-4H2,(H,6,7).
What are the key properties of N-ethenyl-N'-(2-hydroxyethyl)methanimidamide?
N-ethenyl-N'-(2-hydroxyethyl)methanimidamide has a molecular weight of 114.15 g/mol, XLogP of -0.26, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N'-(2-hydroxyethyl)methanimidamide is sourced from PubChem (CID 90250549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).