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

C10H24N2O2 — CID 104710921

IUPAC3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol
SMILESCCC(C)N(CCOC)C(CN)CO
InChIInChI=1S/C10H24N2O2/c1-4-9(2)12(5-6-14-3)10(7-11)8-13/h9-10,13H,4-8,11H2,1-3H3
InChIKeyOEGQTIZKHLNFSL-UHFFFAOYSA-N
MW204.31 g/mol
LogP0.05
Rot. Bonds8

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

3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol (PubChem CID 104710921) has the molecular formula C10H24N2O2 and a molecular weight of 204.31 g/mol. Its IUPAC name is 3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol.

Molecular Properties

Compound Name3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol
PubChem CID104710921
Molecular FormulaC10H24N2O2
Molecular Weight204.31 g/mol
Exact Mass204.18
IUPAC Name3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol
SMILESCCC(C)N(CCOC)C(CN)CO
InChIInChI=1S/C10H24N2O2/c1-4-9(2)12(5-6-14-3)10(7-11)8-13/h9-10,13H,4-8,11H2,1-3H3
InChIKeyOEGQTIZKHLNFSL-UHFFFAOYSA-N
XLogP0.05
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-3-[butan-2-yl(2-methoxyethyl)amino]-N-propylbutanamide
CID 66428258
3-amino-2-[2-methoxyethyl(methyl)amino]propan-1-ol
CID 104710884
ethyl 2-[butan-2-yl(2-methoxyethyl)amino]pentanoate
CID 83041497
tert-butyl N-[4-amino-3-[butan-2-yl(2-methoxyethyl)amino]butyl]carbamate
CID 102729842
4-amino-2-[butan-2-yl(2-methoxyethyl)amino]butanoic acid
CID 64693788
3-amino-2-[propan-2-yl(propyl)amino]propan-1-ol
CID 104710820
3-amino-2-[2-methoxyethyl(pentan-3-yl)amino]pentan-1-ol
CID 104840396
4-amino-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-N-propan-2-ylbutanamide
CID 66432620
3-amino-2-[3-methoxypropyl(methyl)amino]propan-1-ol
CID 104710985
4-amino-3-[2-methoxyethyl(pentan-3-yl)amino]-N,N-dimethylbutanamide
CID 66431664
4-amino-3-[2-methoxyethyl(pentan-3-yl)amino]-N-methylbutanamide
CID 66429475
tert-butyl 2-[butan-2-yl(2-methoxyethyl)amino]propanoate
CID 64688775

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol?
The IUPAC name of 3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol (CID 104710921) is 3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol.
What is the SMILES notation for 3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol?
The canonical SMILES for 3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol is CCC(C)N(CCOC)C(CN)CO.
What is the InChIKey of 3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol?
The InChIKey is OEGQTIZKHLNFSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2/c1-4-9(2)12(5-6-14-3)10(7-11)8-13/h9-10,13H,4-8,11H2,1-3H3.
What are the key properties of 3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol?
3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol has a molecular weight of 204.31 g/mol, XLogP of 0.05, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol is sourced from PubChem (CID 104710921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).