2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol

C15H26N2O — CID 82216500

IUPAC2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol
SMILESCC(C)CN(CC(C)C)CC(O)c1ccncc1
InChIInChI=1S/C15H26N2O/c1-12(2)9-17(10-13(3)4)11-15(18)14-5-7-16-8-6-14/h5-8,12-13,15,18H,9-11H2,1-4H3
InChIKeyFUHMMTLYPFAEPZ-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.73
Rot. Bonds7

About 2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol

2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol (PubChem CID 82216500) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol.

Molecular Properties

Compound Name2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol
PubChem CID82216500
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol
SMILESCC(C)CN(CC(C)C)CC(O)c1ccncc1
InChIInChI=1S/C15H26N2O/c1-12(2)9-17(10-13(3)4)11-15(18)14-5-7-16-8-6-14/h5-8,12-13,15,18H,9-11H2,1-4H3
InChIKeyFUHMMTLYPFAEPZ-UHFFFAOYSA-N
XLogP2.73
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[bis(2-methylpropyl)amino]-1-(4-methoxyphenyl)ethanol
CID 60969080
2-[ethyl(2-methylpropyl)amino]-1-(4-propan-2-ylphenyl)ethanol
CID 54949371
2-[benzyl(ethyl)amino]-1-pyridin-4-ylethanol
CID 112501695
1,3-dipyridin-4-ylpropane-1,3-diol
CID 153433085
2-[bis(2-methylpropyl)amino]-1-(3,4-difluorophenyl)ethanol
CID 82217067
1-[4-(aminomethyl)phenyl]-2-[ethyl(2-methylpropyl)amino]ethanol
CID 43273373
6-methyl-2-pyridin-4-ylheptan-3-ol
CID 66460886
1-(4-aminophenyl)-2-[2-methoxyethyl(2-methylpropyl)amino]ethanol
CID 62265758
N-methyl-N-(2-methylpropyl)pyridin-4-amine
CID 123668191
1-pyridin-4-yltridecan-1-ol
CID 63410309
2-[amino(2-methylpropyl)amino]-1-phenylethanol
CID 21361101
2-[[2-(4-fluorophenyl)-2-hydroxyethyl]-(2-methylpropyl)amino]-N,N-dimethylacetamide
CID 111462207

Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol?
The IUPAC name of 2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol (CID 82216500) is 2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol.
What is the SMILES notation for 2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol?
The canonical SMILES for 2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol is CC(C)CN(CC(C)C)CC(O)c1ccncc1.
What is the InChIKey of 2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol?
The InChIKey is FUHMMTLYPFAEPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-12(2)9-17(10-13(3)4)11-15(18)14-5-7-16-8-6-14/h5-8,12-13,15,18H,9-11H2,1-4H3.
What are the key properties of 2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol?
2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol has a molecular weight of 250.39 g/mol, XLogP of 2.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-methylpropyl)amino]-1-pyridin-4-ylethanol is sourced from PubChem (CID 82216500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).