[5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol

C13H14N2O2 — CID 69490375

IUPAC[5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol
SMILESCc1cc(N)ccc1Oc1ccc(CO)nc1
InChIInChI=1S/C13H14N2O2/c1-9-6-10(14)2-5-13(9)17-12-4-3-11(8-16)15-7-12/h2-7,16H,8,14H2,1H3
InChIKeyULZDVZHLKIEQAS-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.26
Rot. Bonds3

About [5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol

[5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol (PubChem CID 69490375) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is [5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol
PubChem CID69490375
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name[5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol
SMILESCc1cc(N)ccc1Oc1ccc(CO)nc1
InChIInChI=1S/C13H14N2O2/c1-9-6-10(14)2-5-13(9)17-12-4-3-11(8-16)15-7-12/h2-7,16H,8,14H2,1H3
InChIKeyULZDVZHLKIEQAS-UHFFFAOYSA-N
XLogP2.26
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[5-(2-methyl-4-nitrophenoxy)-2-pyridinyl]methanol
CID 69259295
4-[(5-methoxy-2-pyridinyl)oxy]-3-methylaniline
CID 106504339
[5-(4-bromo-2-methylphenoxy)-2-pyridinyl]methanamine
CID 113320455
4-(1,3-benzothiazol-5-yloxy)-3-methylaniline
CID 66937132
4-[6-(aminomethyl)pyrimidin-4-yl]oxy-3-methylaniline
CID 68537192
5-(5-amino-2-methylphenoxy)pyridine-2-carbonitrile
CID 113321409
6-(4-amino-2-methylphenoxy)-1H-indazol-3-amine
CID 142889541
5-amino-2-[(6-methyl-3-pyridinyl)oxy]benzonitrile
CID 62074114
ethyl 2-[[6-(hydroxymethyl)-3-pyridinyl]oxy]butanoate
CID 79800006
N'-hydroxy-3-methyl-4-[(6-methyl-3-pyridinyl)oxy]benzenecarboximidamide
CID 55031079
(3-methyl-4-pyridin-3-yloxyphenyl)methanol
CID 62124917
3-methyl-4-pyridin-2-yloxyaniline
CID 69194589

Frequently Asked Questions

What is the IUPAC name of [5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol?
The IUPAC name of [5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol (CID 69490375) is [5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol.
What is the SMILES notation for [5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol?
The canonical SMILES for [5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol is Cc1cc(N)ccc1Oc1ccc(CO)nc1.
What is the InChIKey of [5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol?
The InChIKey is ULZDVZHLKIEQAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-9-6-10(14)2-5-13(9)17-12-4-3-11(8-16)15-7-12/h2-7,16H,8,14H2,1H3.
What are the key properties of [5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol?
[5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol has a molecular weight of 230.27 g/mol, XLogP of 2.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(4-amino-2-methylphenoxy)-2-pyridinyl]methanol is sourced from PubChem (CID 69490375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).