3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol

C10H24N2O3 — CID 64899164

IUPAC3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol
SMILESCOCCN(CCOC)C(CO)C(C)N
InChIInChI=1S/C10H24N2O3/c1-9(11)10(8-13)12(4-6-14-2)5-7-15-3/h9-10,13H,4-8,11H2,1-3H3
InChIKeyGFPFBLNQTUMOAU-UHFFFAOYSA-N
MW220.31 g/mol
LogP-0.71
Rot. Bonds9

About 3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol

3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol (PubChem CID 64899164) has the molecular formula C10H24N2O3 and a molecular weight of 220.31 g/mol. Its IUPAC name is 3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol.

Molecular Properties

Compound Name3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol
PubChem CID64899164
Molecular FormulaC10H24N2O3
Molecular Weight220.31 g/mol
Exact Mass220.18
IUPAC Name3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol
SMILESCOCCN(CCOC)C(CO)C(C)N
InChIInChI=1S/C10H24N2O3/c1-9(11)10(8-13)12(4-6-14-2)5-7-15-3/h9-10,13H,4-8,11H2,1-3H3
InChIKeyGFPFBLNQTUMOAU-UHFFFAOYSA-N
XLogP-0.71
TPSA67.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-2-[2-ethoxyethyl(ethyl)amino]butan-1-ol
CID 64897671
3-amino-2-[ethyl(2-methoxyethyl)amino]-4-methylpentan-1-ol
CID 114356911
3-N-ethyl-3-N-(2-methoxyethyl)butane-2,3-diamine
CID 61448111
3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol
CID 61067521
(2R)-1-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine
CID 103934791
N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide
CID 104861637
3-amino-2-[2-methoxyethyl(pentan-3-yl)amino]pentan-1-ol
CID 104840396
3-amino-4-methoxy-2-[propan-2-yl(propyl)amino]butan-1-ol
CID 114356584
3-[2-hydroxyethyl(2-methoxyethyl)amino]-2-methylpropan-1-ol
CID 115872995
2-amino-4-[1-cyclopropylethyl(2-methoxyethyl)amino]butan-1-ol
CID 64826962
3-amino-2-[ethyl(2,2,2-trifluoroethyl)amino]butan-1-ol
CID 64898086
3-amino-2-[cyclopropyl(2-methoxyethyl)amino]-4-methoxybutan-1-ol
CID 114356929

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol?
The IUPAC name of 3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol (CID 64899164) is 3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol.
What is the SMILES notation for 3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol?
The canonical SMILES for 3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol is COCCN(CCOC)C(CO)C(C)N.
What is the InChIKey of 3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol?
The InChIKey is GFPFBLNQTUMOAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3/c1-9(11)10(8-13)12(4-6-14-2)5-7-15-3/h9-10,13H,4-8,11H2,1-3H3.
What are the key properties of 3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol?
3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol has a molecular weight of 220.31 g/mol, XLogP of -0.71, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol is sourced from PubChem (CID 64899164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).