2-(dibutylamino)-1-pyridin-3-ylethanol

C15H26N2O — CID 82216499

IUPAC2-(dibutylamino)-1-pyridin-3-ylethanol
SMILESCCCCN(CCCC)CC(O)c1cccnc1
InChIInChI=1S/C15H26N2O/c1-3-5-10-17(11-6-4-2)13-15(18)14-8-7-9-16-12-14/h7-9,12,15,18H,3-6,10-11,13H2,1-2H3
InChIKeyUQGHEGWWEIEHOP-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.02
Rot. Bonds9

About 2-(dibutylamino)-1-pyridin-3-ylethanol

2-(dibutylamino)-1-pyridin-3-ylethanol (PubChem CID 82216499) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-(dibutylamino)-1-pyridin-3-ylethanol.

Molecular Properties

Compound Name2-(dibutylamino)-1-pyridin-3-ylethanol
PubChem CID82216499
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name2-(dibutylamino)-1-pyridin-3-ylethanol
SMILESCCCCN(CCCC)CC(O)c1cccnc1
InChIInChI=1S/C15H26N2O/c1-3-5-10-17(11-6-4-2)13-15(18)14-8-7-9-16-12-14/h7-9,12,15,18H,3-6,10-11,13H2,1-2H3
InChIKeyUQGHEGWWEIEHOP-UHFFFAOYSA-N
XLogP3.02
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dipropylamino)-1-pyridin-3-ylethanol
CID 82216469
3-[(2-hydroxy-2-pyridin-3-ylethyl)-methylamino]propanoic acid
CID 82216497
N,N-dibutyl-1-pyridin-3-ylethane-1,2-diamine
CID 43125913
(1S)-1-pyridin-3-ylhexan-1-amine
CID 94506966
4-ethylsulfonyl-1-pyridin-3-ylbutan-1-ol
CID 65098166
(1S)-2-(methylamino)-1-pyridin-3-ylethanol
CID 10171254
2-(N-ethyl-3-methylanilino)-1-pyridin-3-ylethanol
CID 82216494
(1R)-2-[butyl(2-hydroxyethyl)amino]-1-(4-fluorophenyl)ethanol
CID 95170921
N,N-dibutylbutan-1-amine;pyridine-3-sulfonic acid
CID 175275478
4-[2-(dibutylamino)-1-hydroxyethyl]benzenecarbothioamide
CID 43290538
3-decan-5-ylpyridine
CID 170375029
3-tridecan-7-ylpyridine
CID 129119745

Frequently Asked Questions

What is the IUPAC name of 2-(dibutylamino)-1-pyridin-3-ylethanol?
The IUPAC name of 2-(dibutylamino)-1-pyridin-3-ylethanol (CID 82216499) is 2-(dibutylamino)-1-pyridin-3-ylethanol.
What is the SMILES notation for 2-(dibutylamino)-1-pyridin-3-ylethanol?
The canonical SMILES for 2-(dibutylamino)-1-pyridin-3-ylethanol is CCCCN(CCCC)CC(O)c1cccnc1.
What is the InChIKey of 2-(dibutylamino)-1-pyridin-3-ylethanol?
The InChIKey is UQGHEGWWEIEHOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-3-5-10-17(11-6-4-2)13-15(18)14-8-7-9-16-12-14/h7-9,12,15,18H,3-6,10-11,13H2,1-2H3.
What are the key properties of 2-(dibutylamino)-1-pyridin-3-ylethanol?
2-(dibutylamino)-1-pyridin-3-ylethanol has a molecular weight of 250.39 g/mol, XLogP of 3.02, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dibutylamino)-1-pyridin-3-ylethanol is sourced from PubChem (CID 82216499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).