1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol

C10H20N2O2 — CID 12032451

IUPAC1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol
SMILESC=CCNCC(O)CN1CCOCC1
InChIInChI=1S/C10H20N2O2/c1-2-3-11-8-10(13)9-12-4-6-14-7-5-12/h2,10-11,13H,1,3-9H2
InChIKeyLFSYXRYDMRICLZ-UHFFFAOYSA-N
MW200.28 g/mol
LogP-0.54
Rot. Bonds6

About 1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol

1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol (PubChem CID 12032451) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol.

Molecular Properties

Compound Name1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol
PubChem CID12032451
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol
SMILESC=CCNCC(O)CN1CCOCC1
InChIInChI=1S/C10H20N2O2/c1-2-3-11-8-10(13)9-12-4-6-14-7-5-12/h2,10-11,13H,1,3-9H2
InChIKeyLFSYXRYDMRICLZ-UHFFFAOYSA-N
XLogP-0.54
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol 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 1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol?
The IUPAC name of 1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol (CID 12032451) is 1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol.
What is the SMILES notation for 1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol?
The canonical SMILES for 1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol is C=CCNCC(O)CN1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol?
The InChIKey is LFSYXRYDMRICLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-2-3-11-8-10(13)9-12-4-6-14-7-5-12/h2,10-11,13H,1,3-9H2.
What are the key properties of 1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol?
1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol has a molecular weight of 200.28 g/mol, XLogP of -0.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-3-(prop-2-enylamino)propan-2-ol is sourced from PubChem (CID 12032451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).