[3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol

C16H20N2O2 — CID 79238949

IUPAC[3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol
SMILESCCCNc1cccc(COc2cccc(CO)c2)n1
InChIInChI=1S/C16H20N2O2/c1-2-9-17-16-8-4-6-14(18-16)12-20-15-7-3-5-13(10-15)11-19/h3-8,10,19H,2,9,11-12H2,1H3,(H,17,18)
InChIKeyJAUADLOSZANKQW-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.97
Rot. Bonds7

About [3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol

[3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol (PubChem CID 79238949) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is [3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol.

Molecular Properties

Compound Name[3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol
PubChem CID79238949
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name[3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol
SMILESCCCNc1cccc(COc2cccc(CO)c2)n1
InChIInChI=1S/C16H20N2O2/c1-2-9-17-16-8-4-6-14(18-16)12-20-15-7-3-5-13(10-15)11-19/h3-8,10,19H,2,9,11-12H2,1H3,(H,17,18)
InChIKeyJAUADLOSZANKQW-UHFFFAOYSA-N
XLogP2.97
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine
CID 79239613
[3-[[2-(propylamino)-3-pyridinyl]methoxy]phenyl]methanol
CID 62467832
6-[[3-(hydroxymethyl)phenoxy]methyl]pyridine-2-carboxylic acid
CID 106903344
6-(pentoxymethyl)-N-propylpyridin-2-amine
CID 79238780
[3-[[5-(methylamino)pyrazin-2-yl]methoxy]phenyl]methanol
CID 103058951
N-ethyl-6-(naphthalen-2-yloxymethyl)pyridin-2-amine
CID 79231800
[3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol
CID 62189596
6-[(4-tert-butylphenoxy)methyl]-N-ethylpyridin-2-amine
CID 79231253
6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine
CID 79239120
N-ethyl-6-[(4-propoxyphenoxy)methyl]pyridin-2-amine
CID 79232344
[3-(1,3-thiazol-4-ylmethoxy)phenyl]methanol
CID 28782947
[3-[(1-methylpyrazol-3-yl)methoxy]phenyl]methanol
CID 82866640

Frequently Asked Questions

What is the IUPAC name of [3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol?
The IUPAC name of [3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol (CID 79238949) is [3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol.
What is the SMILES notation for [3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol?
The canonical SMILES for [3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol is CCCNc1cccc(COc2cccc(CO)c2)n1.
What is the InChIKey of [3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol?
The InChIKey is JAUADLOSZANKQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-2-9-17-16-8-4-6-14(18-16)12-20-15-7-3-5-13(10-15)11-19/h3-8,10,19H,2,9,11-12H2,1H3,(H,17,18).
What are the key properties of [3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol?
[3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol has a molecular weight of 272.35 g/mol, XLogP of 2.97, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[6-(propylamino)-2-pyridinyl]methoxy]phenyl]methanol is sourced from PubChem (CID 79238949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).