1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol

C9H20N2O3 — CID 6611037

IUPAC1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol
SMILESNCC(O)COCCN1CCOCC1
InChIInChI=1S/C9H20N2O3/c10-7-9(12)8-14-6-3-11-1-4-13-5-2-11/h9,12H,1-8,10H2
InChIKeyALJHSVJMRDDPSP-UHFFFAOYSA-N
MW204.27 g/mol
LogP-1.35
Rot. Bonds6

About 1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol

1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol (PubChem CID 6611037) has the molecular formula C9H20N2O3 and a molecular weight of 204.27 g/mol. Its IUPAC name is 1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol.

Molecular Properties

Compound Name1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol
PubChem CID6611037
Molecular FormulaC9H20N2O3
Molecular Weight204.27 g/mol
Exact Mass204.15
IUPAC Name1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol
SMILESNCC(O)COCCN1CCOCC1
InChIInChI=1S/C9H20N2O3/c10-7-9(12)8-14-6-3-11-1-4-13-5-2-11/h9,12H,1-8,10H2
InChIKeyALJHSVJMRDDPSP-UHFFFAOYSA-N
XLogP-1.35
TPSA67.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 5-1.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol?
The IUPAC name of 1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol (CID 6611037) is 1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol.
What is the SMILES notation for 1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol?
The canonical SMILES for 1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol is NCC(O)COCCN1CCOCC1.
What is the InChIKey of 1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol?
The InChIKey is ALJHSVJMRDDPSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3/c10-7-9(12)8-14-6-3-11-1-4-13-5-2-11/h9,12H,1-8,10H2.
What are the key properties of 1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol?
1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol has a molecular weight of 204.27 g/mol, XLogP of -1.35, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(2-morpholin-4-ylethoxy)propan-2-ol is sourced from PubChem (CID 6611037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).