6-[(2-phenoxyethylamino)methyl]pyridin-3-ol

C14H16N2O2 — CID 79783259

IUPAC6-[(2-phenoxyethylamino)methyl]pyridin-3-ol
SMILESOc1ccc(CNCCOc2ccccc2)nc1
InChIInChI=1S/C14H16N2O2/c17-13-7-6-12(16-11-13)10-15-8-9-18-14-4-2-1-3-5-14/h1-7,11,15,17H,8-10H2
InChIKeyFTLVBJMLNSMQDD-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.96
Rot. Bonds6

About 6-[(2-phenoxyethylamino)methyl]pyridin-3-ol

6-[(2-phenoxyethylamino)methyl]pyridin-3-ol (PubChem CID 79783259) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 6-[(2-phenoxyethylamino)methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[(2-phenoxyethylamino)methyl]pyridin-3-ol
PubChem CID79783259
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name6-[(2-phenoxyethylamino)methyl]pyridin-3-ol
SMILESOc1ccc(CNCCOc2ccccc2)nc1
InChIInChI=1S/C14H16N2O2/c17-13-7-6-12(16-11-13)10-15-8-9-18-14-4-2-1-3-5-14/h1-7,11,15,17H,8-10H2
InChIKeyFTLVBJMLNSMQDD-UHFFFAOYSA-N
XLogP1.96
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[(5-methyl-2-pyridinyl)methyl]-3-phenoxypropan-1-amine
CID 80708453
N-[[5-(2-phenoxyethoxy)-2-pyridinyl]methyl]ethanamine
CID 79775994
6-[(2-phenoxyethylamino)methyl]pyridine-2-carboxylic acid
CID 106904547
6-[2-[4-[2-(methylamino)ethoxy]phenyl]-3-phenylpent-2-enyl]pyridin-3-ol
CID 123768993
6-[(3,3,3-trifluoropropylamino)methyl]pyridin-3-ol
CID 79793918
6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol
CID 79794912
(5S)-5-[[4-[2-[(5-phenylmethoxy-2-pyridinyl)methylamino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
CID 98005992
N-benzyl-3-phenoxypropan-1-amine
CID 13291924
6-[(3-phenoxypropylamino)methyl]pyridine-2-carboxylic acid
CID 106904670
6-[(3-methylsulfanylpropylamino)methyl]pyridin-3-ol
CID 79794102
6-[[2-(1,3-thiazol-4-yl)ethylamino]methyl]pyridin-3-ol
CID 79794984
3-phenoxy-N-(thiadiazol-4-ylmethyl)propan-1-amine
CID 62380767

Frequently Asked Questions

What is the IUPAC name of 6-[(2-phenoxyethylamino)methyl]pyridin-3-ol?
The IUPAC name of 6-[(2-phenoxyethylamino)methyl]pyridin-3-ol (CID 79783259) is 6-[(2-phenoxyethylamino)methyl]pyridin-3-ol.
What is the SMILES notation for 6-[(2-phenoxyethylamino)methyl]pyridin-3-ol?
The canonical SMILES for 6-[(2-phenoxyethylamino)methyl]pyridin-3-ol is Oc1ccc(CNCCOc2ccccc2)nc1.
What is the InChIKey of 6-[(2-phenoxyethylamino)methyl]pyridin-3-ol?
The InChIKey is FTLVBJMLNSMQDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c17-13-7-6-12(16-11-13)10-15-8-9-18-14-4-2-1-3-5-14/h1-7,11,15,17H,8-10H2.
What are the key properties of 6-[(2-phenoxyethylamino)methyl]pyridin-3-ol?
6-[(2-phenoxyethylamino)methyl]pyridin-3-ol has a molecular weight of 244.29 g/mol, XLogP of 1.96, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-phenoxyethylamino)methyl]pyridin-3-ol is sourced from PubChem (CID 79783259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).