2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol

C14H16N2O2 — CID 122547918

IUPAC2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol
SMILESCOCc1ccnc(-c2cc(CCO)ccn2)c1
InChIInChI=1S/C14H16N2O2/c1-18-10-12-3-6-16-14(9-12)13-8-11(4-7-17)2-5-15-13/h2-3,5-6,8-9,17H,4,7,10H2,1H3
InChIKeyVOAJGTOWQYFPDM-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.82
Rot. Bonds5

About 2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol

2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol (PubChem CID 122547918) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol.

Molecular Properties

Compound Name2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol
PubChem CID122547918
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol
SMILESCOCc1ccnc(-c2cc(CCO)ccn2)c1
InChIInChI=1S/C14H16N2O2/c1-18-10-12-3-6-16-14(9-12)13-8-11(4-7-17)2-5-15-13/h2-3,5-6,8-9,17H,4,7,10H2,1H3
InChIKeyVOAJGTOWQYFPDM-UHFFFAOYSA-N
XLogP1.82
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Metyrapol
CID 161210
4'-(Methoxycarbonyl)-[2,2'-bipyridine]-4-carboxylic acid
CID 25138011
4,4'-Bis(hydroxymethyl)-2,2'-bipyridine
CID 11160239
TRPV3 antagonist 74a
CID 71554840
1,2-Di-4-pyridinyl-1,2-ethanediol
CID 95639
(1S)-1-phenyl-2-(pyridin-2-yl)ethan-1-ol
CID 11310145
2,3-Di-3-pyridylbutane-2,3-diol
CID 579621
4-Hydroxymethyl-4'-methyl-2,2'-bipyridyl
CID 2754750
6'-Methoxy-2,3'-bipyridyl
CID 10899365
[4-(Pyrazin-2-yl)phenyl]methanol
CID 22631039
2-Methyl-1,2-di-pyridin-3-yl-1-methoxypropane
CID 44299128
(5-Phenyl-2-pyridin-2-yl-4,5-dihydro-1,3-oxazol-4-yl)methanol
CID 3241242

Frequently Asked Questions

What is the IUPAC name of 2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol?
The IUPAC name of 2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol (CID 122547918) is 2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol.
What is the SMILES notation for 2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol?
The canonical SMILES for 2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol is COCc1ccnc(-c2cc(CCO)ccn2)c1.
What is the InChIKey of 2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol?
The InChIKey is VOAJGTOWQYFPDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-18-10-12-3-6-16-14(9-12)13-8-11(4-7-17)2-5-15-13/h2-3,5-6,8-9,17H,4,7,10H2,1H3.
What are the key properties of 2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol?
2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol has a molecular weight of 244.29 g/mol, XLogP of 1.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[4-(methoxymethyl)-2-pyridinyl]-4-pyridinyl]ethanol is sourced from PubChem (CID 122547918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).