5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol

C18H19N3O3 — CID 131891693

IUPAC5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol
SMILESCc1ncc(CO)c(CNCc2coc(-c3ccccc3)n2)c1O
InChIInChI=1S/C18H19N3O3/c1-12-17(23)16(14(10-22)7-20-12)9-19-8-15-11-24-18(21-15)13-5-3-2-4-6-13/h2-7,11,19,22-23H,8-10H2,1H3
InChIKeyDGTMMQKOKWQBAF-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.53
Rot. Bonds6

About 5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol

5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol (PubChem CID 131891693) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is 5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol
PubChem CID131891693
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC Name5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol
SMILESCc1ncc(CO)c(CNCc2coc(-c3ccccc3)n2)c1O
InChIInChI=1S/C18H19N3O3/c1-12-17(23)16(14(10-22)7-20-12)9-19-8-15-11-24-18(21-15)13-5-3-2-4-6-13/h2-7,11,19,22-23H,8-10H2,1H3
InChIKeyDGTMMQKOKWQBAF-UHFFFAOYSA-N
XLogP2.53
TPSA91.41 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol with MolForge

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Related Compounds

4-[(2-hydroxyethylamino)methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
CID 54137000
[3-[(2-phenyl-1,3-oxazol-4-yl)methylamino]-4-pyridinyl]methanol
CID 84595089
ethane;5-(hydroxymethyl)-2-methyl-4-(methylaminomethyl)pyridin-3-ol
CID 144604155
4-[[(6-fluoro-2-pyridinyl)amino]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
CID 116812929
2-[[2-(4-methylphenyl)-1,3-oxazol-4-yl]methylamino]ethanol
CID 110884956
5-(hydroxymethyl)-4-[(methoxyamino)methyl]-2-methylpyridin-3-ol
CID 116686483
4-[(2-phenyl-1,3-oxazol-4-yl)methylamino]butanoic acid
CID 43473610
4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]oxan-4-ol
CID 111698359
2-methyl-2-[(2-phenyl-1,3-oxazol-4-yl)methylamino]pentan-1-ol
CID 111432763
5-(hydroxymethyl)-2-methyl-4-[(3-methylanilino)methyl]pyridin-3-ol
CID 20914681
4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyrrolidin-3-ol
CID 120961897
4-[[1-(2-chlorophenyl)ethylamino]methyl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
CID 116686234

Frequently Asked Questions

What is the IUPAC name of 5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol?
The IUPAC name of 5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol (CID 131891693) is 5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol.
What is the SMILES notation for 5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol?
The canonical SMILES for 5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol is Cc1ncc(CO)c(CNCc2coc(-c3ccccc3)n2)c1O.
What is the InChIKey of 5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol?
The InChIKey is DGTMMQKOKWQBAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-12-17(23)16(14(10-22)7-20-12)9-19-8-15-11-24-18(21-15)13-5-3-2-4-6-13/h2-7,11,19,22-23H,8-10H2,1H3.
What are the key properties of 5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol?
5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol has a molecular weight of 325.37 g/mol, XLogP of 2.53, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(hydroxymethyl)-2-methyl-4-[[(2-phenyl-1,3-oxazol-4-yl)methylamino]methyl]pyridin-3-ol is sourced from PubChem (CID 131891693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).