1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol

C13H29NO4 — CID 61059447

IUPAC1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol
SMILESCOCCN(CC(O)COC(C)C)C(C)COC
InChIInChI=1S/C13H29NO4/c1-11(2)18-10-13(15)8-14(6-7-16-4)12(3)9-17-5/h11-13,15H,6-10H2,1-5H3
InChIKeyHJLUSOZQBLDRLK-UHFFFAOYSA-N
MW263.38 g/mol
LogP0.76
Rot. Bonds11

About 1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol

1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol (PubChem CID 61059447) has the molecular formula C13H29NO4 and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol.

Molecular Properties

Compound Name1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol
PubChem CID61059447
Molecular FormulaC13H29NO4
Molecular Weight263.38 g/mol
Exact Mass263.21
IUPAC Name1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol
SMILESCOCCN(CC(O)COC(C)C)C(C)COC
InChIInChI=1S/C13H29NO4/c1-11(2)18-10-13(15)8-14(6-7-16-4)12(3)9-17-5/h11-13,15H,6-10H2,1-5H3
InChIKeyHJLUSOZQBLDRLK-UHFFFAOYSA-N
XLogP0.76
TPSA51.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol with MolForge

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Related Compounds

(2R)-1-[bis(2-methoxyethyl)amino]-3-propan-2-yloxypropan-2-ol
CID 95357959
1-[bis(2-methoxyethyl)amino]-3-propan-2-yloxypropan-2-ol
CID 60635415
1-[2-methoxyethyl(3-methoxypropyl)amino]-3-propan-2-yloxypropan-2-ol
CID 61035306
1-(2-methoxyethylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-2-ol
CID 115475131
1-(dipropylamino)-3-propan-2-yloxypropan-2-ol
CID 60634039
N,N-bis(2-methoxyethyl)-1,3-di(propan-2-yloxy)propan-2-amine
CID 176738332
1-[1-cyclopropylethyl(2-methoxyethyl)amino]-3-methoxypropan-2-ol
CID 63928354
1-[bis(2-methoxyethyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991830
1-amino-4-[2-methoxyethyl(1-methoxypropan-2-yl)amino]butan-2-ol
CID 64821591
1-[2-methoxyethyl(methyl)amino]-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991846
(2S)-1-[butan-2-yl(2-methoxyethyl)amino]propan-2-ol
CID 103935046
2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]acetamide
CID 61072169

Frequently Asked Questions

What is the IUPAC name of 1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol?
The IUPAC name of 1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol (CID 61059447) is 1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol.
What is the SMILES notation for 1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol?
The canonical SMILES for 1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol is COCCN(CC(O)COC(C)C)C(C)COC.
What is the InChIKey of 1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol?
The InChIKey is HJLUSOZQBLDRLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO4/c1-11(2)18-10-13(15)8-14(6-7-16-4)12(3)9-17-5/h11-13,15H,6-10H2,1-5H3.
What are the key properties of 1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol?
1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol has a molecular weight of 263.38 g/mol, XLogP of 0.76, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol is sourced from PubChem (CID 61059447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).