4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol

C12H28N2O3 — CID 64827181

IUPAC4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol
SMILESCNC(C)(CO)CCN(CCOC)CCOC
InChIInChI=1S/C12H28N2O3/c1-12(11-15,13-2)5-6-14(7-9-16-3)8-10-17-4/h13,15H,5-11H2,1-4H3
InChIKeyLHXUQGDXCJAJJK-UHFFFAOYSA-N
MW248.37 g/mol
LogP-0.06
Rot. Bonds11

About 4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol

4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol (PubChem CID 64827181) has the molecular formula C12H28N2O3 and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol.

Molecular Properties

Compound Name4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol
PubChem CID64827181
Molecular FormulaC12H28N2O3
Molecular Weight248.37 g/mol
Exact Mass248.21
IUPAC Name4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol
SMILESCNC(C)(CO)CCN(CCOC)CCOC
InChIInChI=1S/C12H28N2O3/c1-12(11-15,13-2)5-6-14(7-9-16-3)8-10-17-4/h13,15H,5-11H2,1-4H3
InChIKeyLHXUQGDXCJAJJK-UHFFFAOYSA-N
XLogP-0.06
TPSA53.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[2-methoxyethyl(methyl)amino]-2-methyl-2-(methylamino)pentan-1-ol
CID 64825401
5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-2-methyl-2-(methylamino)pentan-1-ol
CID 64825594
5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methyl-2-(methylamino)pentan-1-ol
CID 104567691
5-[bis(2-methoxyethyl)amino]-2-(cyclopropylamino)-2-methylpentan-1-ol
CID 64827377
4-[ethyl(2-methoxyethyl)amino]-2-methyl-2-(methylamino)pentan-1-ol
CID 64826351
2-ethyl-5-[2-methoxyethyl(3-methoxypropyl)amino]-2-(methylamino)pentan-1-ol
CID 106809480
5-[1-methoxypropan-2-yl(methyl)amino]-2-methyl-2-(methylamino)pentan-1-ol
CID 64825910
3-(2-methoxyethoxy)-2-methyl-2-(methylamino)propan-1-ol
CID 64803416
4-[2-ethoxyethyl(methyl)amino]-2-methyl-2-(methylamino)butan-1-ol
CID 81064710
6-[ethyl(1-methoxypropan-2-yl)amino]-2-methyl-2-(methylamino)hexan-1-ol
CID 64826103
5-[ethyl(2-methoxyethyl)amino]-2-methyl-2-(propylamino)pentan-1-ol
CID 64825355
6-[ethyl(2-methoxyethyl)amino]-2-methyl-2-(propylamino)hexan-1-ol
CID 64825748

Frequently Asked Questions

What is the IUPAC name of 4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol?
The IUPAC name of 4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol (CID 64827181) is 4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol.
What is the SMILES notation for 4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol?
The canonical SMILES for 4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol is CNC(C)(CO)CCN(CCOC)CCOC.
What is the InChIKey of 4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol?
The InChIKey is LHXUQGDXCJAJJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2O3/c1-12(11-15,13-2)5-6-14(7-9-16-3)8-10-17-4/h13,15H,5-11H2,1-4H3.
What are the key properties of 4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol?
4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol has a molecular weight of 248.37 g/mol, XLogP of -0.06, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[bis(2-methoxyethyl)amino]-2-methyl-2-(methylamino)butan-1-ol is sourced from PubChem (CID 64827181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).