2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine

C10H23NO2 — CID 58427609

IUPAC2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine
SMILESCCC(C)OCC(C)OC(C)(C)N
InChIInChI=1S/C10H23NO2/c1-6-8(2)12-7-9(3)13-10(4,5)11/h8-9H,6-7,11H2,1-5H3
InChIKeyIGPHZJSMMZTWQD-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.90
Rot. Bonds6

About 2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine

2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine (PubChem CID 58427609) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine.

Molecular Properties

Compound Name2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine
PubChem CID58427609
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine
SMILESCCC(C)OCC(C)OC(C)(C)N
InChIInChI=1S/C10H23NO2/c1-6-8(2)12-7-9(3)13-10(4,5)11/h8-9H,6-7,11H2,1-5H3
InChIKeyIGPHZJSMMZTWQD-UHFFFAOYSA-N
XLogP1.90
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1,3-di(butan-2-yloxy)propan-2-ol
CID 22072723
1-butan-2-yloxypropan-2-yl formate
CID 139655513
2-amino-3-butan-2-yloxypropan-1-ol
CID 64808148
CID 174061801
CID 174061801
3-butan-2-yloxy-1,1,1-trifluoropropan-2-ol
CID 21353311
1-(2-aminopropan-2-yloxy)-N,N-dimethylpropan-1-amine
CID 174784058
2-[2-[2-(2,4,4-trimethylpentan-2-yloxy)propoxy]propoxy]propan-1-amine
CID 130252040
2-[2-(2,3,5-trimethylheptan-3-yloxy)propoxy]propan-1-ol
CID 142712710
2-[1-butan-2-yloxy-1-[1,1-di(butan-2-yloxy)ethoxy]ethoxy]butane
CID 87588712
O-(butan-2-yloxymethyl)hydroxylamine
CID 130564339
(3-butan-2-yloxy-2-hydroxypropyl)-trimethylazanium
CID 88878402
(3-butan-2-yloxy-2-hydroxypropyl) acetate
CID 134215732

Frequently Asked Questions

What is the IUPAC name of 2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine?
The IUPAC name of 2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine (CID 58427609) is 2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine.
What is the SMILES notation for 2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine?
The canonical SMILES for 2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine is CCC(C)OCC(C)OC(C)(C)N.
What is the InChIKey of 2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine?
The InChIKey is IGPHZJSMMZTWQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-6-8(2)12-7-9(3)13-10(4,5)11/h8-9H,6-7,11H2,1-5H3.
What are the key properties of 2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine?
2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine has a molecular weight of 189.30 g/mol, XLogP of 1.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-butan-2-yloxypropan-2-yloxy)propan-2-amine is sourced from PubChem (CID 58427609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).