(Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol

C5H11NO2 — CID 101275159

IUPAC(Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol
SMILESC/C(O)=C/NCCO
InChIInChI=1S/C5H11NO2/c1-5(8)4-6-2-3-7/h4,6-8H,2-3H2,1H3/b5-4-
InChIKeyLINDSSFNDBOYEB-PLNGDYQASA-N
MW117.15 g/mol
LogP-0.01
Rot. Bonds3

About (Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol

(Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol (PubChem CID 101275159) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is (Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol.

Molecular Properties

Compound Name(Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol
PubChem CID101275159
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC Name(Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol
SMILESC/C(O)=C/NCCO
InChIInChI=1S/C5H11NO2/c1-5(8)4-6-2-3-7/h4,6-8H,2-3H2,1H3/b5-4-
InChIKeyLINDSSFNDBOYEB-PLNGDYQASA-N
XLogP-0.01
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 5-0.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol?
The IUPAC name of (Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol (CID 101275159) is (Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol.
What is the SMILES notation for (Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol?
The canonical SMILES for (Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol is C/C(O)=C/NCCO.
What is the InChIKey of (Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol?
The InChIKey is LINDSSFNDBOYEB-PLNGDYQASA-N. The full InChI is InChI=1S/C5H11NO2/c1-5(8)4-6-2-3-7/h4,6-8H,2-3H2,1H3/b5-4-.
What are the key properties of (Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol?
(Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol has a molecular weight of 117.15 g/mol, XLogP of -0.01, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-(2-hydroxyethylamino)prop-1-en-2-ol is sourced from PubChem (CID 101275159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).