(2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine

C15H33NO5 — CID 157049293

IUPAC(2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine
SMILESCOCCOC[C@H](C)OC[C@H](C)OC[C@@H](C)OC[C@@H](C)N
InChIInChI=1S/C15H33NO5/c1-12(16)8-19-14(3)10-21-15(4)11-20-13(2)9-18-7-6-17-5/h12-15H,6-11,16H2,1-5H3/t12-,13+,14-,15+/m1/s1
InChIKeyJXGRSFWTZMOYKY-BARDWOONSA-N
MW307.43 g/mol
LogP1.21
Rot. Bonds14

About (2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine

(2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine (PubChem CID 157049293) has the molecular formula C15H33NO5 and a molecular weight of 307.43 g/mol. Its IUPAC name is (2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine.

Molecular Properties

Compound Name(2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine
PubChem CID157049293
Molecular FormulaC15H33NO5
Molecular Weight307.43 g/mol
Exact Mass307.24
IUPAC Name(2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine
SMILESCOCCOC[C@H](C)OC[C@H](C)OC[C@@H](C)OC[C@@H](C)N
InChIInChI=1S/C15H33NO5/c1-12(16)8-19-14(3)10-21-15(4)11-20-13(2)9-18-7-6-17-5/h12-15H,6-11,16H2,1-5H3/t12-,13+,14-,15+/m1/s1
InChIKeyJXGRSFWTZMOYKY-BARDWOONSA-N
XLogP1.21
TPSA72.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.43
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze (2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Aminomethyl-18-crown-6
CID 5080255
2-Aminomethyl-15-crown-5
CID 5204231
Jeffamine
CID 15131492
(2r)-1-[(2r)-2-(2-Methoxyethoxy)propoxy]propan-2-Amine
CID 91819620
3,6,9,12,15-Pentaoxaoctadecan-17-Amine
CID 124081749
(2~{R})-1-[(2~{R})-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-amine
CID 155295715
(2~{R})-1-[(2~{R})-1-[(2~{R})-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-amine
CID 157049295
(2~{S})-1-[(2~{R})-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-amine
CID 157049299
O-(2-aminopropyl)-O'-(2-methyoxyethyl)octa(propylene glycol)
CID 45480539
1-[2-(2-Aminopropoxy)ethoxy]propan-2-amine
CID 19962281
GlyTouCan:G38887KP
CID 13643887
1,1'-[Propane-1,2-diylbis(oxy)]di(propan-2-amine)
CID 15131491

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine?
The IUPAC name of (2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine (CID 157049293) is (2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine.
What is the SMILES notation for (2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine?
The canonical SMILES for (2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine is COCCOC[C@H](C)OC[C@H](C)OC[C@@H](C)OC[C@@H](C)N.
What is the InChIKey of (2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine?
The InChIKey is JXGRSFWTZMOYKY-BARDWOONSA-N. The full InChI is InChI=1S/C15H33NO5/c1-12(16)8-19-14(3)10-21-15(4)11-20-13(2)9-18-7-6-17-5/h12-15H,6-11,16H2,1-5H3/t12-,13+,14-,15+/m1/s1.
What are the key properties of (2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine?
(2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine has a molecular weight of 307.43 g/mol, XLogP of 1.21, 14 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(2R)-1-[(2S)-1-[(2S)-1-(2-methoxyethoxy)propan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-amine is sourced from PubChem (CID 157049293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).