2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol

C11H25NO3 — CID 103491094

IUPAC2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol
SMILESCCOCC(C)OC(C)CC(C)(N)CO
InChIInChI=1S/C11H25NO3/c1-5-14-7-10(3)15-9(2)6-11(4,12)8-13/h9-10,13H,5-8,12H2,1-4H3
InChIKeyPYVGIMWVQQNQED-UHFFFAOYSA-N
MW219.32 g/mol
LogP0.92
Rot. Bonds8

About 2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol

2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol (PubChem CID 103491094) has the molecular formula C11H25NO3 and a molecular weight of 219.32 g/mol. Its IUPAC name is 2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol.

Molecular Properties

Compound Name2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol
PubChem CID103491094
Molecular FormulaC11H25NO3
Molecular Weight219.32 g/mol
Exact Mass219.18
IUPAC Name2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol
SMILESCCOCC(C)OC(C)CC(C)(N)CO
InChIInChI=1S/C11H25NO3/c1-5-14-7-10(3)15-9(2)6-11(4,12)8-13/h9-10,13H,5-8,12H2,1-4H3
InChIKeyPYVGIMWVQQNQED-UHFFFAOYSA-N
XLogP0.92
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.32
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylbutan-1-ol
CID 103491080
2-amino-2-methyl-4-(2-propan-2-yloxyethoxy)pentan-1-ol
CID 64802797
2-amino-4-(4-methoxyphenoxy)-2-methylpentan-1-ol
CID 64802307
2-amino-2-methyl-3-(2-methylpentoxy)propan-1-ol
CID 103286036
2-amino-2-methyl-4-[4-(2-methylbutan-2-yl)phenoxy]pentan-1-ol
CID 64802073
2-amino-4-(cyclopropylmethoxy)-2-methylpentan-1-ol
CID 64802601
2-amino-3-(1-ethoxypropan-2-yloxy)-2-methylpropanenitrile
CID 103489757
2-amino-4-(3-methoxypropoxy)-2-methylpentan-1-ol
CID 64810813
4-(1-ethoxypropan-2-yloxy)pentanoic acid
CID 103486244
2-amino-2-methyl-4-[methyl(propan-2-yl)amino]pentan-1-ol
CID 64796081
1-(2-amino-2-methylpropoxy)-3-ethoxypropan-2-ol
CID 106939938
2-amino-2-methylpropane-1,3-diol;propan-2-ol
CID 18519501

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol?
The IUPAC name of 2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol (CID 103491094) is 2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol.
What is the SMILES notation for 2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol?
The canonical SMILES for 2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol is CCOCC(C)OC(C)CC(C)(N)CO.
What is the InChIKey of 2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol?
The InChIKey is PYVGIMWVQQNQED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3/c1-5-14-7-10(3)15-9(2)6-11(4,12)8-13/h9-10,13H,5-8,12H2,1-4H3.
What are the key properties of 2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol?
2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol has a molecular weight of 219.32 g/mol, XLogP of 0.92, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylpentan-1-ol is sourced from PubChem (CID 103491094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).