3-(2-ethylbutylamino)-4-methoxybutan-1-ol

C11H25NO2 — CID 115756936

IUPAC3-(2-ethylbutylamino)-4-methoxybutan-1-ol
SMILESCCC(CC)CNC(CCO)COC
InChIInChI=1S/C11H25NO2/c1-4-10(5-2)8-12-11(6-7-13)9-14-3/h10-13H,4-9H2,1-3H3
InChIKeyNAXFOHAIMOOVSV-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.41
Rot. Bonds9

About 3-(2-ethylbutylamino)-4-methoxybutan-1-ol

3-(2-ethylbutylamino)-4-methoxybutan-1-ol (PubChem CID 115756936) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is 3-(2-ethylbutylamino)-4-methoxybutan-1-ol.

Molecular Properties

Compound Name3-(2-ethylbutylamino)-4-methoxybutan-1-ol
PubChem CID115756936
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Name3-(2-ethylbutylamino)-4-methoxybutan-1-ol
SMILESCCC(CC)CNC(CCO)COC
InChIInChI=1S/C11H25NO2/c1-4-10(5-2)8-12-11(6-7-13)9-14-3/h10-13H,4-9H2,1-3H3
InChIKeyNAXFOHAIMOOVSV-UHFFFAOYSA-N
XLogP1.41
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1-methoxyhexan-2-ylamino)-3-methylbutan-1-ol
CID 115725096
3-(3-ethoxypropylamino)-4-methoxybutan-1-ol
CID 106159789
4-methoxy-3-(2-propan-2-yloxyethylamino)butan-1-ol
CID 106159775
3-(1-methoxypentan-2-ylamino)propane-1,2-diol
CID 77035883
3-(heptan-3-ylamino)-4-methoxybutan-1-ol
CID 115722634
4-methoxy-3-(3-methylbut-3-enylamino)butan-1-ol
CID 106159692
4-methoxy-3-(3-methylsulfanylpropylamino)butan-1-ol
CID 106156471
3-[[3-(4-ethylphenoxy)-2-hydroxypropyl]amino]-4-methoxybutan-1-ol
CID 106159851
4-methoxy-3-(4-methylpentan-2-ylamino)butan-1-ol
CID 115722598
N-(4-hydroxy-1-methoxybutan-2-yl)ethanesulfonamide
CID 103887492
3-[(3-cyclohexyloxy-2-hydroxypropyl)amino]-4-methoxybutan-1-ol
CID 106159619
butyl 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]acetate
CID 106159517

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylbutylamino)-4-methoxybutan-1-ol?
The IUPAC name of 3-(2-ethylbutylamino)-4-methoxybutan-1-ol (CID 115756936) is 3-(2-ethylbutylamino)-4-methoxybutan-1-ol.
What is the SMILES notation for 3-(2-ethylbutylamino)-4-methoxybutan-1-ol?
The canonical SMILES for 3-(2-ethylbutylamino)-4-methoxybutan-1-ol is CCC(CC)CNC(CCO)COC.
What is the InChIKey of 3-(2-ethylbutylamino)-4-methoxybutan-1-ol?
The InChIKey is NAXFOHAIMOOVSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-4-10(5-2)8-12-11(6-7-13)9-14-3/h10-13H,4-9H2,1-3H3.
What are the key properties of 3-(2-ethylbutylamino)-4-methoxybutan-1-ol?
3-(2-ethylbutylamino)-4-methoxybutan-1-ol has a molecular weight of 203.33 g/mol, XLogP of 1.41, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylbutylamino)-4-methoxybutan-1-ol is sourced from PubChem (CID 115756936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).