3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol

C10H21NO2 — CID 68639029

IUPAC3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol
SMILESOCCCN(CCO)CC1CCC1
InChIInChI=1S/C10H21NO2/c12-7-2-5-11(6-8-13)9-10-3-1-4-10/h10,12-13H,1-9H2
InChIKeyZDITZZVDHHWYMD-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.46
Rot. Bonds7

About 3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol

3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol (PubChem CID 68639029) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol.

Molecular Properties

Compound Name3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol
PubChem CID68639029
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol
SMILESOCCCN(CCO)CC1CCC1
InChIInChI=1S/C10H21NO2/c12-7-2-5-11(6-8-13)9-10-3-1-4-10/h10,12-13H,1-9H2
InChIKeyZDITZZVDHHWYMD-UHFFFAOYSA-N
XLogP0.46
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[cyclobutylmethyl(ethyl)amino]propan-1-ol
CID 115666204
2-[cyclopentylmethyl(cyclopropylmethyl)amino]ethanol
CID 115593687
4-[cyclohexylmethyl(propyl)amino]butan-1-ol
CID 110931716
3-[piperidin-3-ylmethyl(propyl)amino]propan-1-ol
CID 106640793
2-[cyclohexylmethyl(piperidin-4-ylmethyl)amino]ethanol;hydrochloride
CID 120849278
7-[bis(cyclopentylmethyl)amino]hept-4-en-1-ol
CID 123172681
3-[2-hydroxyethyl(3-hydroxypropyl)amino]propan-1-ol;methane
CID 158407678
6-[cyclopropylmethyl(ethyl)amino]hexan-1-ol
CID 103737958
2-[2-hydroxyethyl-[(4-methoxycyclohexyl)methyl]amino]ethanol
CID 138519661
N'-(cyclohexylmethyl)-N'-[3-(dimethylamino)propyl]-N,N-dimethylpropane-1,3-diamine
CID 2055566
2-[[1-[3-(dimethylamino)propyl]piperidin-4-yl]methyl-(2-hydroxyethyl)amino]ethanol
CID 54060629
2-[cyclohex-3-en-1-ylmethyl(2-hydroxyethyl)amino]ethanol
CID 2846062

Frequently Asked Questions

What is the IUPAC name of 3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol?
The IUPAC name of 3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol (CID 68639029) is 3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol.
What is the SMILES notation for 3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol?
The canonical SMILES for 3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol is OCCCN(CCO)CC1CCC1.
What is the InChIKey of 3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol?
The InChIKey is ZDITZZVDHHWYMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c12-7-2-5-11(6-8-13)9-10-3-1-4-10/h10,12-13H,1-9H2.
What are the key properties of 3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol?
3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol has a molecular weight of 187.28 g/mol, XLogP of 0.46, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclobutylmethyl(2-hydroxyethyl)amino]propan-1-ol is sourced from PubChem (CID 68639029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).