2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide

C7H13N3O2 — CID 143768550

IUPAC2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide
SMILESC=CCN1CCN(C(N)=O)C1O
InChIInChI=1S/C7H13N3O2/c1-2-3-9-4-5-10(6(8)11)7(9)12/h2,7,12H,1,3-5H2,(H2,8,11)
InChIKeyOWZOKFYTXXNDJV-UHFFFAOYSA-N
MW171.20 g/mol
LogP-0.86
Rot. Bonds2

About 2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide

2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide (PubChem CID 143768550) has the molecular formula C7H13N3O2 and a molecular weight of 171.20 g/mol. Its IUPAC name is 2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide.

Molecular Properties

Compound Name2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide
PubChem CID143768550
Molecular FormulaC7H13N3O2
Molecular Weight171.20 g/mol
Exact Mass171.10
IUPAC Name2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide
SMILESC=CCN1CCN(C(N)=O)C1O
InChIInChI=1S/C7H13N3O2/c1-2-3-9-4-5-10(6(8)11)7(9)12/h2,7,12H,1,3-5H2,(H2,8,11)
InChIKeyOWZOKFYTXXNDJV-UHFFFAOYSA-N
XLogP-0.86
TPSA69.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide?
The IUPAC name of 2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide (CID 143768550) is 2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide.
What is the SMILES notation for 2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide?
The canonical SMILES for 2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide is C=CCN1CCN(C(N)=O)C1O.
What is the InChIKey of 2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide?
The InChIKey is OWZOKFYTXXNDJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2/c1-2-3-9-4-5-10(6(8)11)7(9)12/h2,7,12H,1,3-5H2,(H2,8,11).
What are the key properties of 2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide?
2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide has a molecular weight of 171.20 g/mol, XLogP of -0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-prop-2-enylimidazolidine-1-carboxamide is sourced from PubChem (CID 143768550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).