[2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol

C11H17NO3 — CID 61256549

IUPAC[2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol
SMILESCC(C)OCCOc1cc(CO)ccn1
InChIInChI=1S/C11H17NO3/c1-9(2)14-5-6-15-11-7-10(8-13)3-4-12-11/h3-4,7,9,13H,5-6,8H2,1-2H3
InChIKeyKVHYTUWMGJXESJ-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.38
Rot. Bonds6

About [2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol

[2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol (PubChem CID 61256549) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is [2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol
PubChem CID61256549
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name[2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol
SMILESCC(C)OCCOc1cc(CO)ccn1
InChIInChI=1S/C11H17NO3/c1-9(2)14-5-6-15-11-7-10(8-13)3-4-12-11/h3-4,7,9,13H,5-6,8H2,1-2H3
InChIKeyKVHYTUWMGJXESJ-UHFFFAOYSA-N
XLogP1.38
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(chloromethyl)-2-(2-propan-2-yloxyethoxy)pyridine
CID 61268408
(2-propoxy-4-pyridinyl)methanol
CID 61256143
[2-(1-phenylethoxy)-4-pyridinyl]methanol
CID 61256752
[2-(2,2-difluoroethoxy)-4-pyridinyl]methanol
CID 82007049
[2-[2-[cyclopropyl(methyl)amino]ethoxy]-4-pyridinyl]methanol
CID 102740402
[2-[(2-methylpropan-2-yl)oxy]-4-pyridinyl]methanol
CID 61257367
1-[(2-methoxy-4-pyridinyl)methylamino]-3-(2-propan-2-yloxyethoxy)propan-2-ol
CID 62989903
[4-(2-propan-2-yloxyethoxy)-3-pyridinyl]methanol
CID 81237043
[3-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol
CID 105067127
[2-(4-methylsulfanylphenoxy)-4-pyridinyl]methanol
CID 55245584
[2-(dimethylamino)-4-pyridinyl]methanol
CID 22625066
[2-(4-fluorophenoxy)-4-pyridinyl]methanol
CID 61257536

Frequently Asked Questions

What is the IUPAC name of [2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol?
The IUPAC name of [2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol (CID 61256549) is [2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol.
What is the SMILES notation for [2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol?
The canonical SMILES for [2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol is CC(C)OCCOc1cc(CO)ccn1.
What is the InChIKey of [2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol?
The InChIKey is KVHYTUWMGJXESJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-9(2)14-5-6-15-11-7-10(8-13)3-4-12-11/h3-4,7,9,13H,5-6,8H2,1-2H3.
What are the key properties of [2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol?
[2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol has a molecular weight of 211.26 g/mol, XLogP of 1.38, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-propan-2-yloxyethoxy)-4-pyridinyl]methanol is sourced from PubChem (CID 61256549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).