1-[2-(1-aminoethoxy)ethoxy]propan-2-amine

C7H18N2O2 — CID 153419048

IUPAC1-[2-(1-aminoethoxy)ethoxy]propan-2-amine
SMILESCC(N)COCCOC(C)N
InChIInChI=1S/C7H18N2O2/c1-6(8)5-10-3-4-11-7(2)9/h6-7H,3-5,8-9H2,1-2H3
InChIKeyHSICTJLATXJYQA-UHFFFAOYSA-N
MW162.23 g/mol
LogP-0.33
Rot. Bonds6

About 1-[2-(1-aminoethoxy)ethoxy]propan-2-amine

1-[2-(1-aminoethoxy)ethoxy]propan-2-amine (PubChem CID 153419048) has the molecular formula C7H18N2O2 and a molecular weight of 162.23 g/mol. Its IUPAC name is 1-[2-(1-aminoethoxy)ethoxy]propan-2-amine.

Molecular Properties

Compound Name1-[2-(1-aminoethoxy)ethoxy]propan-2-amine
PubChem CID153419048
Molecular FormulaC7H18N2O2
Molecular Weight162.23 g/mol
Exact Mass162.14
IUPAC Name1-[2-(1-aminoethoxy)ethoxy]propan-2-amine
SMILESCC(N)COCCOC(C)N
InChIInChI=1S/C7H18N2O2/c1-6(8)5-10-3-4-11-7(2)9/h6-7H,3-5,8-9H2,1-2H3
InChIKeyHSICTJLATXJYQA-UHFFFAOYSA-N
XLogP-0.33
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2S)-1-[2-(2-methylpropoxy)ethoxy]propan-2-amine
CID 106447202
1-[2-[1-(2-aminopropoxy)propan-2-yloxy]ethoxy]propan-2-amine;methane;yttrium
CID 159748487
(2S)-1-[2-(2-methoxyethoxy)ethoxy]propan-2-amine
CID 104560725
2-[(2R)-2-aminopropoxy]ethanol
CID 21097963
(2R)-1-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]propan-2-amine
CID 104560995
1-(2-butoxyethoxy)propan-2-amine
CID 43127528
(2S)-1-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-2-amine
CID 103939491
2-[2-[2-(2-aminopropoxy)propoxy]ethoxy]propan-1-amine
CID 58898571
2-[2-(1-aminoethoxy)ethoxy]acetic acid
CID 19037384
1-[2-(dimethylamino)ethoxy]propan-2-amine
CID 164578140
1-[1-[2-(2-amino-2-chloroethoxy)ethoxy]propan-2-yloxy]propan-2-amine
CID 59972165
(2R)-1-[(2R)-1-[(2R)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-amine
CID 157049295

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-aminoethoxy)ethoxy]propan-2-amine?
The IUPAC name of 1-[2-(1-aminoethoxy)ethoxy]propan-2-amine (CID 153419048) is 1-[2-(1-aminoethoxy)ethoxy]propan-2-amine.
What is the SMILES notation for 1-[2-(1-aminoethoxy)ethoxy]propan-2-amine?
The canonical SMILES for 1-[2-(1-aminoethoxy)ethoxy]propan-2-amine is CC(N)COCCOC(C)N.
What is the InChIKey of 1-[2-(1-aminoethoxy)ethoxy]propan-2-amine?
The InChIKey is HSICTJLATXJYQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O2/c1-6(8)5-10-3-4-11-7(2)9/h6-7H,3-5,8-9H2,1-2H3.
What are the key properties of 1-[2-(1-aminoethoxy)ethoxy]propan-2-amine?
1-[2-(1-aminoethoxy)ethoxy]propan-2-amine has a molecular weight of 162.23 g/mol, XLogP of -0.33, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-aminoethoxy)ethoxy]propan-2-amine is sourced from PubChem (CID 153419048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).