2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol

C13H21NO3 — CID 134597504

IUPAC2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol
SMILESCC(C)Oc1cncc(CC(C)OCCO)c1
InChIInChI=1S/C13H21NO3/c1-10(2)17-13-7-12(8-14-9-13)6-11(3)16-5-4-15/h7-11,15H,4-6H2,1-3H3
InChIKeyAWSVOJZYAHTYDR-UHFFFAOYSA-N
MW239.31 g/mol
LogP1.81
Rot. Bonds7

About 2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol

2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol (PubChem CID 134597504) has the molecular formula C13H21NO3 and a molecular weight of 239.31 g/mol. Its IUPAC name is 2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol.

Molecular Properties

Compound Name2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol
PubChem CID134597504
Molecular FormulaC13H21NO3
Molecular Weight239.31 g/mol
Exact Mass239.15
IUPAC Name2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol
SMILESCC(C)Oc1cncc(CC(C)OCCO)c1
InChIInChI=1S/C13H21NO3/c1-10(2)17-13-7-12(8-14-9-13)6-11(3)16-5-4-15/h7-11,15H,4-6H2,1-3H3
InChIKeyAWSVOJZYAHTYDR-UHFFFAOYSA-N
XLogP1.81
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-propan-2-yloxy-3-pyridinyl)ethanimidamide
CID 83878395
3-methoxy-5-(2-methylpropyl)pyridine
CID 58531249
3-[(5-bromo-3-pyridinyl)oxy]butan-1-ol
CID 174205406
3-methylsulfanyl-5-propan-2-yloxypyridine
CID 146035348
N-aminosulfanyl-N-(5-propan-2-yloxy-3-pyridinyl)hydroxylamine
CID 146416991
(2R)-2-amino-3-(5-methoxy-3-pyridinyl)propanoic acid
CID 55268885
3-bromo-5-propan-2-yloxypyridine;5-propan-2-yloxypyridin-3-amine
CID 158462322
5-(1-methoxypropan-2-yloxy)pyridin-3-amine
CID 104536800
4-phenyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-one
CID 105124809
2-ethoxy-3,3-dimethyl-1-(5-propan-2-yloxy-3-pyridinyl)butan-1-amine
CID 116725313
(2S)-2-(2-hydroxyethoxy)propan-1-ol
CID 87093044
1-(5-propan-2-yloxy-3-pyridinyl)-2-propylpentan-1-one
CID 115794638

Frequently Asked Questions

What is the IUPAC name of 2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol?
The IUPAC name of 2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol (CID 134597504) is 2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol.
What is the SMILES notation for 2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol?
The canonical SMILES for 2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol is CC(C)Oc1cncc(CC(C)OCCO)c1.
What is the InChIKey of 2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol?
The InChIKey is AWSVOJZYAHTYDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO3/c1-10(2)17-13-7-12(8-14-9-13)6-11(3)16-5-4-15/h7-11,15H,4-6H2,1-3H3.
What are the key properties of 2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol?
2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol has a molecular weight of 239.31 g/mol, XLogP of 1.81, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(5-propan-2-yloxy-3-pyridinyl)propan-2-yloxy]ethanol is sourced from PubChem (CID 134597504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).