3-[(5-methyl-2-pyridinyl)methylamino]phenol

C13H14N2O — CID 81311516

IUPAC3-[(5-methyl-2-pyridinyl)methylamino]phenol
SMILESCc1ccc(CNc2cccc(O)c2)nc1
InChIInChI=1S/C13H14N2O/c1-10-5-6-12(14-8-10)9-15-11-3-2-4-13(16)7-11/h2-8,15-16H,9H2,1H3
InChIKeyLBPGEQOFLPOZKZ-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.71
Rot. Bonds3

About 3-[(5-methyl-2-pyridinyl)methylamino]phenol

3-[(5-methyl-2-pyridinyl)methylamino]phenol (PubChem CID 81311516) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 3-[(5-methyl-2-pyridinyl)methylamino]phenol.

Molecular Properties

Compound Name3-[(5-methyl-2-pyridinyl)methylamino]phenol
PubChem CID81311516
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name3-[(5-methyl-2-pyridinyl)methylamino]phenol
SMILESCc1ccc(CNc2cccc(O)c2)nc1
InChIInChI=1S/C13H14N2O/c1-10-5-6-12(14-8-10)9-15-11-3-2-4-13(16)7-11/h2-8,15-16H,9H2,1H3
InChIKeyLBPGEQOFLPOZKZ-UHFFFAOYSA-N
XLogP2.71
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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3-Phenyl-5-(pyridin-3-ylamino)phenol
CID 25115110
2-[[(6-Phenyl-3-pyridinyl)amino]methyl]phenol
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4-Methyl-3-(4-quinolinylamino)phenol
CID 127052672
4-[2-(Diethylamino)ethylamino]quinolin-7-ol
CID 135545286
(E)-3-(3-(4-Diethylamino-2-hydroxybenzylidene)-3,4,5,6-tetrahydropyridin-2-yl)pyridine
CID 135869153
3-methoxy-N-[[6-[(3-methoxyanilino)methyl]-3-pyridinyl]methyl]aniline
CID 155522746
Quinolinium, 7-hydroxy-1-methyl-
CID 765302

Frequently Asked Questions

What is the IUPAC name of 3-[(5-methyl-2-pyridinyl)methylamino]phenol?
The IUPAC name of 3-[(5-methyl-2-pyridinyl)methylamino]phenol (CID 81311516) is 3-[(5-methyl-2-pyridinyl)methylamino]phenol.
What is the SMILES notation for 3-[(5-methyl-2-pyridinyl)methylamino]phenol?
The canonical SMILES for 3-[(5-methyl-2-pyridinyl)methylamino]phenol is Cc1ccc(CNc2cccc(O)c2)nc1.
What is the InChIKey of 3-[(5-methyl-2-pyridinyl)methylamino]phenol?
The InChIKey is LBPGEQOFLPOZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-10-5-6-12(14-8-10)9-15-11-3-2-4-13(16)7-11/h2-8,15-16H,9H2,1H3.
What are the key properties of 3-[(5-methyl-2-pyridinyl)methylamino]phenol?
3-[(5-methyl-2-pyridinyl)methylamino]phenol has a molecular weight of 214.27 g/mol, XLogP of 2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-methyl-2-pyridinyl)methylamino]phenol is sourced from PubChem (CID 81311516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).