2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol

C7H15NO2 — CID 45088074

IUPAC2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol
SMILESC=C(C)N(CCO)CCO
InChIInChI=1S/C7H15NO2/c1-7(2)8(3-5-9)4-6-10/h9-10H,1,3-6H2,2H3
InChIKeyMNHWCBVQDROXJT-UHFFFAOYSA-N
MW145.20 g/mol
LogP-0.19
Rot. Bonds5

About 2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol

2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol (PubChem CID 45088074) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol
PubChem CID45088074
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol
SMILESC=C(C)N(CCO)CCO
InChIInChI=1S/C7H15NO2/c1-7(2)8(3-5-9)4-6-10/h9-10H,1,3-6H2,2H3
InChIKeyMNHWCBVQDROXJT-UHFFFAOYSA-N
XLogP-0.19
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol?
The IUPAC name of 2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol (CID 45088074) is 2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol.
What is the SMILES notation for 2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol?
The canonical SMILES for 2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol is C=C(C)N(CCO)CCO.
What is the InChIKey of 2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol?
The InChIKey is MNHWCBVQDROXJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-7(2)8(3-5-9)4-6-10/h9-10H,1,3-6H2,2H3.
What are the key properties of 2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol?
2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol has a molecular weight of 145.20 g/mol, XLogP of -0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(prop-1-en-2-yl)amino]ethanol is sourced from PubChem (CID 45088074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).