[2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol

C14H14ClNO2 — CID 114320498

IUPAC[2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol
SMILESOCc1c(Cl)cccc1OCCc1ccncc1
InChIInChI=1S/C14H14ClNO2/c15-13-2-1-3-14(12(13)10-17)18-9-6-11-4-7-16-8-5-11/h1-5,7-8,17H,6,9-10H2
InChIKeyQBEQPOCBGBVMCU-UHFFFAOYSA-N
MW263.72 g/mol
LogP2.85
Rot. Bonds5

About [2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol

[2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol (PubChem CID 114320498) has the molecular formula C14H14ClNO2 and a molecular weight of 263.72 g/mol. Its IUPAC name is [2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol.

Molecular Properties

Compound Name[2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol
PubChem CID114320498
Molecular FormulaC14H14ClNO2
Molecular Weight263.72 g/mol
Exact Mass263.07
IUPAC Name[2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol
SMILESOCc1c(Cl)cccc1OCCc1ccncc1
InChIInChI=1S/C14H14ClNO2/c15-13-2-1-3-14(12(13)10-17)18-9-6-11-4-7-16-8-5-11/h1-5,7-8,17H,6,9-10H2
InChIKeyQBEQPOCBGBVMCU-UHFFFAOYSA-N
XLogP2.85
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.72
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]propan-2-amine
CID 114321819
N-[[2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methyl]cyclopropanamine
CID 114319356
[2-chloro-6-[2-(4-nitrophenyl)ethoxy]phenyl]methanol
CID 114320497
2-chloro-6-(2-pyridin-4-ylethoxy)benzonitrile
CID 114322554
[2-chloro-6-(2-imidazol-1-ylethoxy)phenyl]methanol
CID 114320427
[2-chloro-6-[3-(dimethylamino)propoxy]phenyl]methanol
CID 114525693
(2-chloro-6-pent-4-enoxyphenyl)methanol
CID 114320409
4-[3-chloro-2-(hydroxymethyl)phenoxy]-2-methylbutan-2-ol
CID 114320455
3-[2-(2-pyridin-4-ylethoxy)phenyl]prop-2-yn-1-ol
CID 60890550
3-[3-chloro-2-(hydroxymethyl)phenoxy]propane-1,2-diol
CID 82850685
N-[2-(2-chlorophenoxy)ethyl]-N-methyl-2-pyridin-4-ylethanamine
CID 75402095
2-[2-chloro-6-[2-(4-methoxyphenyl)ethoxy]phenyl]ethanamine
CID 114321645

Frequently Asked Questions

What is the IUPAC name of [2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol?
The IUPAC name of [2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol (CID 114320498) is [2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol.
What is the SMILES notation for [2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol?
The canonical SMILES for [2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol is OCc1c(Cl)cccc1OCCc1ccncc1.
What is the InChIKey of [2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol?
The InChIKey is QBEQPOCBGBVMCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO2/c15-13-2-1-3-14(12(13)10-17)18-9-6-11-4-7-16-8-5-11/h1-5,7-8,17H,6,9-10H2.
What are the key properties of [2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol?
[2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol has a molecular weight of 263.72 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-chloro-6-(2-pyridin-4-ylethoxy)phenyl]methanol is sourced from PubChem (CID 114320498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).