2-[butan-2-yl(pentan-3-yl)amino]ethanol

C11H25NO — CID 62016641

IUPAC2-[butan-2-yl(pentan-3-yl)amino]ethanol
SMILESCCC(C)N(CCO)C(CC)CC
InChIInChI=1S/C11H25NO/c1-5-10(4)12(8-9-13)11(6-2)7-3/h10-11,13H,5-9H2,1-4H3
InChIKeyOBBHMQVTTIEMQQ-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.27
Rot. Bonds7

About 2-[butan-2-yl(pentan-3-yl)amino]ethanol

2-[butan-2-yl(pentan-3-yl)amino]ethanol (PubChem CID 62016641) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 2-[butan-2-yl(pentan-3-yl)amino]ethanol.

Molecular Properties

Compound Name2-[butan-2-yl(pentan-3-yl)amino]ethanol
PubChem CID62016641
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name2-[butan-2-yl(pentan-3-yl)amino]ethanol
SMILESCCC(C)N(CCO)C(CC)CC
InChIInChI=1S/C11H25NO/c1-5-10(4)12(8-9-13)11(6-2)7-3/h10-11,13H,5-9H2,1-4H3
InChIKeyOBBHMQVTTIEMQQ-UHFFFAOYSA-N
XLogP2.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[butan-2-yl(pentan-3-yl)amino]ethanol 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

3-[2-hydroxyethyl(pentan-3-yl)amino]butan-2-one
CID 62035780
N-butyl-2-[2-hydroxyethyl(pentan-3-yl)amino]propanamide
CID 62015666
2-[di(propan-2-yl)amino]ethanol;methane
CID 145105271
2-[2-[butan-2-yl(propan-2-yl)amino]ethyl-(1-hydroxypropan-2-yl)amino]propan-1-ol
CID 22971826
2-[ethyl(2-hydroxyethyl)amino]butan-1-ol
CID 87456981
3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol
CID 104710921
2-[[2-amino-1-(4-methylphenyl)ethyl]-pentan-3-ylamino]ethanol
CID 55016459
2-[(3-bromo-2-methylpropyl)-pentan-3-ylamino]ethanol
CID 64995595
2-[1-[2-[2-hydroxyethyl(methyl)amino]butoxy]butan-2-yl-methylamino]ethanol
CID 141165462
ethyl 2-[2-hydroxyethyl(pentan-3-yl)amino]-2-phenylacetate
CID 106677068
3-[butan-2-yl(ethyl)amino]propan-1-ol
CID 43509660
3-[2-hydroxyethyl(methyl)amino]pentanoic acid
CID 112708683

Frequently Asked Questions

What is the IUPAC name of 2-[butan-2-yl(pentan-3-yl)amino]ethanol?
The IUPAC name of 2-[butan-2-yl(pentan-3-yl)amino]ethanol (CID 62016641) is 2-[butan-2-yl(pentan-3-yl)amino]ethanol.
What is the SMILES notation for 2-[butan-2-yl(pentan-3-yl)amino]ethanol?
The canonical SMILES for 2-[butan-2-yl(pentan-3-yl)amino]ethanol is CCC(C)N(CCO)C(CC)CC.
What is the InChIKey of 2-[butan-2-yl(pentan-3-yl)amino]ethanol?
The InChIKey is OBBHMQVTTIEMQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-5-10(4)12(8-9-13)11(6-2)7-3/h10-11,13H,5-9H2,1-4H3.
What are the key properties of 2-[butan-2-yl(pentan-3-yl)amino]ethanol?
2-[butan-2-yl(pentan-3-yl)amino]ethanol has a molecular weight of 187.33 g/mol, XLogP of 2.27, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butan-2-yl(pentan-3-yl)amino]ethanol is sourced from PubChem (CID 62016641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).