2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol

C15H18N2O3 — CID 134990468

IUPAC2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol
SMILESNCC(O)c1ccc(OCc2ccccc2)c(CO)n1
InChIInChI=1S/C15H18N2O3/c16-8-14(19)12-6-7-15(13(9-18)17-12)20-10-11-4-2-1-3-5-11/h1-7,14,18-19H,8-10,16H2
InChIKeyXGQQIASEJBABHK-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.14
Rot. Bonds6

About 2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol

2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol (PubChem CID 134990468) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol.

Molecular Properties

Compound Name2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol
PubChem CID134990468
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol
SMILESNCC(O)c1ccc(OCc2ccccc2)c(CO)n1
InChIInChI=1S/C15H18N2O3/c16-8-14(19)12-6-7-15(13(9-18)17-12)20-10-11-4-2-1-3-5-11/h1-7,14,18-19H,8-10,16H2
InChIKeyXGQQIASEJBABHK-UHFFFAOYSA-N
XLogP1.14
TPSA88.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-Benzyloxy-2-ethyl-6-methyl-pyridin-4-ylamine
CID 6603362
(2R)-2-[[3-fluoro-6-(2-fluoro-5-propan-2-yloxyphenyl)-2-pyridinyl]methylamino]-3-methylbutan-1-ol
CID 68312406
(2R)-2-[[3-fluoro-6-(3-propan-2-yloxyphenyl)-2-pyridinyl]methylamino]-3-methylbutan-1-ol
CID 68312515
2-{[[2-(2-Allylphenoxy)ethyl](methyl)amino]methyl}-6-methylpyridin-3-ol
CID 46999688
[6-Methyl-3-[[4-(trifluoromethyl)phenyl]methoxy]-2-pyridinyl]methanol
CID 71867088
3-(Benzyloxy)-2-ethyl-6-methyl-4-pyridinamine dihydrochloride
CID 649821
2-(3-Pyridinyloxy)benzenemethanol
CID 43144914
3-[[6-(Hydroxymethyl)-2-pyridinyl]methoxy]-2-methylphenol
CID 155804561
[6-[(3-Hydroxy-2-methylphenoxy)methyl]-2-pyridinyl]methyl nitrate
CID 165430678
(5-(Benzyloxy)pyridin-2-yl)methanol
CID 11736050
3-Benzyloxy-2,6-bis(hydroxymethyl)pyridine
CID 12397255
2-(Tert-butylamino)-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol
CID 21428403

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol?
The IUPAC name of 2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol (CID 134990468) is 2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol.
What is the SMILES notation for 2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol?
The canonical SMILES for 2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol is NCC(O)c1ccc(OCc2ccccc2)c(CO)n1.
What is the InChIKey of 2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol?
The InChIKey is XGQQIASEJBABHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c16-8-14(19)12-6-7-15(13(9-18)17-12)20-10-11-4-2-1-3-5-11/h1-7,14,18-19H,8-10,16H2.
What are the key properties of 2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol?
2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol has a molecular weight of 274.32 g/mol, XLogP of 1.14, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[6-(hydroxymethyl)-5-phenylmethoxy-2-pyridinyl]ethanol is sourced from PubChem (CID 134990468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).