2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol

C13H14N2O2 — CID 105487920

IUPAC2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol
SMILESNCc1cnccc1COc1ccccc1O
InChIInChI=1S/C13H14N2O2/c14-7-11-8-15-6-5-10(11)9-17-13-4-2-1-3-12(13)16/h1-6,8,16H,7,9,14H2
InChIKeyPDUMGGKYAJFLLR-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.82
Rot. Bonds4

About 2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol

2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol (PubChem CID 105487920) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol.

Molecular Properties

Compound Name2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol
PubChem CID105487920
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol
SMILESNCc1cnccc1COc1ccccc1O
InChIInChI=1S/C13H14N2O2/c14-7-11-8-15-6-5-10(11)9-17-13-4-2-1-3-12(13)16/h1-6,8,16H,7,9,14H2
InChIKeyPDUMGGKYAJFLLR-UHFFFAOYSA-N
XLogP1.82
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-amino-4-pyridinyl)methoxy]phenol
CID 105469628
2-[(2-amino-3-pyridinyl)methoxy]phenol
CID 105469613
4-(aminomethyl)pyridin-3-ol
CID 15850356
[3-(aminomethyl)-4-pyridinyl]methanamine;dihydrochloride
CID 66524168
[2-(pyrazin-2-ylmethoxy)phenyl]methanamine
CID 82037246
2-[[4-(aminomethyl)phenyl]methoxy]phenol
CID 105486618
[4-(2-phenylmethoxyethoxy)-3-pyridinyl]methanamine
CID 132587694
[2-(quinolin-8-yloxymethyl)phenyl]methanamine
CID 28824796
4-[(2-methoxyphenoxy)methyl]pyridine-3-carboxylic acid
CID 117212644
[4-(2,3-dimethylphenoxy)-3-pyridinyl]methanamine
CID 81250207
2-[(5-amino-1H-imidazol-2-yl)methoxy]phenol
CID 117187252
2-[(4-amino-1H-imidazol-5-yl)methoxy]phenol
CID 117214152

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol?
The IUPAC name of 2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol (CID 105487920) is 2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol.
What is the SMILES notation for 2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol?
The canonical SMILES for 2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol is NCc1cnccc1COc1ccccc1O.
What is the InChIKey of 2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol?
The InChIKey is PDUMGGKYAJFLLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c14-7-11-8-15-6-5-10(11)9-17-13-4-2-1-3-12(13)16/h1-6,8,16H,7,9,14H2.
What are the key properties of 2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol?
2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol has a molecular weight of 230.27 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(aminomethyl)-4-pyridinyl]methoxy]phenol is sourced from PubChem (CID 105487920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).