1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol

C14H30N2O3 — CID 62014967

IUPAC1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol
SMILESCOCC(O)CN(C)CC1CN(CC(C)C)CCO1
InChIInChI=1S/C14H30N2O3/c1-12(2)7-16-5-6-19-14(10-16)9-15(3)8-13(17)11-18-4/h12-14,17H,5-11H2,1-4H3
InChIKeyDFMBAPFRASROSI-UHFFFAOYSA-N
MW274.41 g/mol
LogP0.28
Rot. Bonds8

About 1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol

1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol (PubChem CID 62014967) has the molecular formula C14H30N2O3 and a molecular weight of 274.41 g/mol. Its IUPAC name is 1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol.

Molecular Properties

Compound Name1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol
PubChem CID62014967
Molecular FormulaC14H30N2O3
Molecular Weight274.41 g/mol
Exact Mass274.23
IUPAC Name1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol
SMILESCOCC(O)CN(C)CC1CN(CC(C)C)CCO1
InChIInChI=1S/C14H30N2O3/c1-12(2)7-16-5-6-19-14(10-16)9-15(3)8-13(17)11-18-4/h12-14,17H,5-11H2,1-4H3
InChIKeyDFMBAPFRASROSI-UHFFFAOYSA-N
XLogP0.28
TPSA45.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol?
The IUPAC name of 1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol (CID 62014967) is 1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol.
What is the SMILES notation for 1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol?
The canonical SMILES for 1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol is COCC(O)CN(C)CC1CN(CC(C)C)CCO1.
What is the InChIKey of 1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol?
The InChIKey is DFMBAPFRASROSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O3/c1-12(2)7-16-5-6-19-14(10-16)9-15(3)8-13(17)11-18-4/h12-14,17H,5-11H2,1-4H3.
What are the key properties of 1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol?
1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol has a molecular weight of 274.41 g/mol, XLogP of 0.28, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-[methyl-[[4-(2-methylpropyl)morpholin-2-yl]methyl]amino]propan-2-ol is sourced from PubChem (CID 62014967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).