1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol

C11H26N2O2 — CID 64822021

IUPAC1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol
SMILESCOCCN(CCC(O)CN)CC(C)C
InChIInChI=1S/C11H26N2O2/c1-10(2)9-13(6-7-15-3)5-4-11(14)8-12/h10-11,14H,4-9,12H2,1-3H3
InChIKeyNOUVSNJUPDCPQI-UHFFFAOYSA-N
MW218.34 g/mol
LogP0.30
Rot. Bonds9

About 1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol

1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol (PubChem CID 64822021) has the molecular formula C11H26N2O2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol.

Molecular Properties

Compound Name1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol
PubChem CID64822021
Molecular FormulaC11H26N2O2
Molecular Weight218.34 g/mol
Exact Mass218.20
IUPAC Name1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol
SMILESCOCCN(CCC(O)CN)CC(C)C
InChIInChI=1S/C11H26N2O2/c1-10(2)9-13(6-7-15-3)5-4-11(14)8-12/h10-11,14H,4-9,12H2,1-3H3
InChIKeyNOUVSNJUPDCPQI-UHFFFAOYSA-N
XLogP0.30
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol 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

N'-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)butane-1,4-diamine
CID 81079086
1-[2-methoxyethyl(2-methylpropyl)amino]-4,4-dimethylpentan-3-ol
CID 62624635
1-amino-4-[2-methoxyethyl(1-methoxypropan-2-yl)amino]butan-2-ol
CID 64821591
2-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butanoic acid
CID 63055687
1-amino-3-[ethyl(2-methoxyethyl)amino]propan-2-ol
CID 61447893
N-[2-(2-aminoethoxy)ethyl]-N-(2-methoxyethyl)-2-methylpropan-1-amine
CID 79478302
N'-(2-methoxyethyl)-N'-(2-methylpropyl)heptane-1,7-diamine
CID 54985939
ethyl 2-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butanoate
CID 63053393
1-[bis(2-methoxyethyl)amino]propan-2-ol
CID 59693413
1-amino-4-[2-methylpropyl(propan-2-yl)amino]butan-2-ol
CID 64820020
2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide
CID 63055154
3-[bis(2-methoxyethyl)amino]propane-1,2-diol
CID 78907099

Frequently Asked Questions

What is the IUPAC name of 1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol?
The IUPAC name of 1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol (CID 64822021) is 1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol.
What is the SMILES notation for 1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol?
The canonical SMILES for 1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol is COCCN(CCC(O)CN)CC(C)C.
What is the InChIKey of 1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol?
The InChIKey is NOUVSNJUPDCPQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O2/c1-10(2)9-13(6-7-15-3)5-4-11(14)8-12/h10-11,14H,4-9,12H2,1-3H3.
What are the key properties of 1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol?
1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol has a molecular weight of 218.34 g/mol, XLogP of 0.30, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol is sourced from PubChem (CID 64822021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).