N-(2-hydroxyprop-2-enyl)formamide

C4H7NO2 — CID 87223348

IUPACN-(2-hydroxyprop-2-enyl)formamide
SMILESC=C(O)CNC=O
InChIInChI=1S/C4H7NO2/c1-4(7)2-5-3-6/h3,7H,1-2H2,(H,5,6)
InChIKeyCVKNGHOWXOJHGW-UHFFFAOYSA-N
MW101.10 g/mol
LogP-0.20
Rot. Bonds3

About N-(2-hydroxyprop-2-enyl)formamide

N-(2-hydroxyprop-2-enyl)formamide (PubChem CID 87223348) has the molecular formula C4H7NO2 and a molecular weight of 101.10 g/mol. Its IUPAC name is N-(2-hydroxyprop-2-enyl)formamide.

Molecular Properties

Compound NameN-(2-hydroxyprop-2-enyl)formamide
PubChem CID87223348
Molecular FormulaC4H7NO2
Molecular Weight101.10 g/mol
Exact Mass101.05
IUPAC NameN-(2-hydroxyprop-2-enyl)formamide
SMILESC=C(O)CNC=O
InChIInChI=1S/C4H7NO2/c1-4(7)2-5-3-6/h3,7H,1-2H2,(H,5,6)
InChIKeyCVKNGHOWXOJHGW-UHFFFAOYSA-N
XLogP-0.20
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.10
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyprop-2-enyl)formamide?
The IUPAC name of N-(2-hydroxyprop-2-enyl)formamide (CID 87223348) is N-(2-hydroxyprop-2-enyl)formamide.
What is the SMILES notation for N-(2-hydroxyprop-2-enyl)formamide?
The canonical SMILES for N-(2-hydroxyprop-2-enyl)formamide is C=C(O)CNC=O.
What is the InChIKey of N-(2-hydroxyprop-2-enyl)formamide?
The InChIKey is CVKNGHOWXOJHGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO2/c1-4(7)2-5-3-6/h3,7H,1-2H2,(H,5,6).
What are the key properties of N-(2-hydroxyprop-2-enyl)formamide?
N-(2-hydroxyprop-2-enyl)formamide has a molecular weight of 101.10 g/mol, XLogP of -0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyprop-2-enyl)formamide is sourced from PubChem (CID 87223348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).