6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol

C11H14N4O — CID 79794277

IUPAC6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol
SMILESCn1nccc1CNCc1ccc(O)cn1
InChIInChI=1S/C11H14N4O/c1-15-10(4-5-14-15)7-12-6-9-2-3-11(16)8-13-9/h2-5,8,12,16H,6-7H2,1H3
InChIKeyRDLLJEWHUIMRLO-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.81
Rot. Bonds4

About 6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol

6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol (PubChem CID 79794277) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol
PubChem CID79794277
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol
SMILESCn1nccc1CNCc1ccc(O)cn1
InChIInChI=1S/C11H14N4O/c1-15-10(4-5-14-15)7-12-6-9-2-3-11(16)8-13-9/h2-5,8,12,16H,6-7H2,1H3
InChIKeyRDLLJEWHUIMRLO-UHFFFAOYSA-N
XLogP0.81
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol?
The IUPAC name of 6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol (CID 79794277) is 6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol.
What is the SMILES notation for 6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol?
The canonical SMILES for 6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol is Cn1nccc1CNCc1ccc(O)cn1.
What is the InChIKey of 6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol?
The InChIKey is RDLLJEWHUIMRLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-15-10(4-5-14-15)7-12-6-9-2-3-11(16)8-13-9/h2-5,8,12,16H,6-7H2,1H3.
What are the key properties of 6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol?
6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol has a molecular weight of 218.26 g/mol, XLogP of 0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyridin-3-ol is sourced from PubChem (CID 79794277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).