2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol

C14H29NO7 — CID 169106537

IUPAC2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol
SMILESNCCOCCOCCOCCOC1CC(O)CC(CO)O1
InChIInChI=1S/C14H29NO7/c15-1-2-18-3-4-19-5-6-20-7-8-21-14-10-12(17)9-13(11-16)22-14/h12-14,16-17H,1-11,15H2
InChIKeyRFCMYGBYMPBSGD-UHFFFAOYSA-N
MW323.39 g/mol
LogP-1.13
Rot. Bonds13

About 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol

2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol (PubChem CID 169106537) has the molecular formula C14H29NO7 and a molecular weight of 323.39 g/mol. Its IUPAC name is 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol.

Molecular Properties

Compound Name2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol
PubChem CID169106537
Molecular FormulaC14H29NO7
Molecular Weight323.39 g/mol
Exact Mass323.19
IUPAC Name2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol
SMILESNCCOCCOCCOCCOC1CC(O)CC(CO)O1
InChIInChI=1S/C14H29NO7/c15-1-2-18-3-4-19-5-6-20-7-8-21-14-10-12(17)9-13(11-16)22-14/h12-14,16-17H,1-11,15H2
InChIKeyRFCMYGBYMPBSGD-UHFFFAOYSA-N
XLogP-1.13
TPSA112.63 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds13
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.39
LogP ≤ 5-1.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2S,6R)-2-(hydroxymethyl)-6-pentoxyoxan-4-ol
CID 146246874
2-[2-[4-[(Z)-2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethylamino]-1-hydrazinylethenyl]phenyl]ethoxy]-6-(hydroxymethyl)oxan-4-ol
CID 169106463
2-(hydroxymethyl)-6-sulfanyloxyoxan-4-ol
CID 177228872
2-(hydroxymethyl)-6-methoxyoxan-4-ol
CID 14831299
[(2S)-6-(2-aminoethoxy)oxan-2-yl]methanol
CID 163533140
6-amino-N-[4-[2-[4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]phenyl]hexanamide
CID 169106484
2-[4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
CID 123211378
2-[2-(6-ethyl-4,5-dimethyloxan-2-yl)oxyethoxy]ethanamine
CID 176946500
ethanamine;ethene;(2S,4R)-2-(hydroxymethyl)-6-methyloxan-4-ol
CID 142157408
(2S)-6-(hydroxymethyl)oxane-2,4-diol
CID 147942620
(2S,4S,6S)-2-[(3R,4S)-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxan-4-ol
CID 138512598
(2S)-7-(hydroxymethyl)-2-[(4-hydroxyoxepan-2-yl)methoxy]oxepan-4-ol
CID 142134321

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol?
The IUPAC name of 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol (CID 169106537) is 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol.
What is the SMILES notation for 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol?
The canonical SMILES for 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol is NCCOCCOCCOCCOC1CC(O)CC(CO)O1.
What is the InChIKey of 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol?
The InChIKey is RFCMYGBYMPBSGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO7/c15-1-2-18-3-4-19-5-6-20-7-8-21-14-10-12(17)9-13(11-16)22-14/h12-14,16-17H,1-11,15H2.
What are the key properties of 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol?
2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol has a molecular weight of 323.39 g/mol, XLogP of -1.13, 13 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]-6-(hydroxymethyl)oxan-4-ol is sourced from PubChem (CID 169106537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).