2-ethoxy-3-propan-2-yloxypropan-1-amine

C8H19NO2 — CID 63069873

IUPAC2-ethoxy-3-propan-2-yloxypropan-1-amine
SMILESCCOC(CN)COC(C)C
InChIInChI=1S/C8H19NO2/c1-4-10-8(5-9)6-11-7(2)3/h7-8H,4-6,9H2,1-3H3
InChIKeyUSGLUFDYYBYRTM-UHFFFAOYSA-N
MW161.25 g/mol
LogP0.78
Rot. Bonds6

About 2-ethoxy-3-propan-2-yloxypropan-1-amine

2-ethoxy-3-propan-2-yloxypropan-1-amine (PubChem CID 63069873) has the molecular formula C8H19NO2 and a molecular weight of 161.25 g/mol. Its IUPAC name is 2-ethoxy-3-propan-2-yloxypropan-1-amine.

Molecular Properties

Compound Name2-ethoxy-3-propan-2-yloxypropan-1-amine
PubChem CID63069873
Molecular FormulaC8H19NO2
Molecular Weight161.25 g/mol
Exact Mass161.14
IUPAC Name2-ethoxy-3-propan-2-yloxypropan-1-amine
SMILESCCOC(CN)COC(C)C
InChIInChI=1S/C8H19NO2/c1-4-10-8(5-9)6-11-7(2)3/h7-8H,4-6,9H2,1-3H3
InChIKeyUSGLUFDYYBYRTM-UHFFFAOYSA-N
XLogP0.78
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 3748064
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CID 5080255
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CID 5204231
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CID 237344
CID 237344
CID 22639371
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CID 15131492
CID 15131492
CID 1133181
CID 1133181
CID 1133182
CID 1133182
CID 58741575
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CID 71758616
CID 71758616
CID 94858066
CID 94858066

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-propan-2-yloxypropan-1-amine?
The IUPAC name of 2-ethoxy-3-propan-2-yloxypropan-1-amine (CID 63069873) is 2-ethoxy-3-propan-2-yloxypropan-1-amine.
What is the SMILES notation for 2-ethoxy-3-propan-2-yloxypropan-1-amine?
The canonical SMILES for 2-ethoxy-3-propan-2-yloxypropan-1-amine is CCOC(CN)COC(C)C.
What is the InChIKey of 2-ethoxy-3-propan-2-yloxypropan-1-amine?
The InChIKey is USGLUFDYYBYRTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2/c1-4-10-8(5-9)6-11-7(2)3/h7-8H,4-6,9H2,1-3H3.
What are the key properties of 2-ethoxy-3-propan-2-yloxypropan-1-amine?
2-ethoxy-3-propan-2-yloxypropan-1-amine has a molecular weight of 161.25 g/mol, XLogP of 0.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-propan-2-yloxypropan-1-amine is sourced from PubChem (CID 63069873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).