5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide

C15H17N3O3 — CID 63860474

IUPAC5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide
SMILESCC(C)Oc1ncccc1CNC(=O)c1cncc(O)c1
InChIInChI=1S/C15H17N3O3/c1-10(2)21-15-11(4-3-5-17-15)8-18-14(20)12-6-13(19)9-16-7-12/h3-7,9-10,19H,8H2,1-2H3,(H,18,20)
InChIKeyLICWIBNUMFWTSM-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.90
Rot. Bonds5

About 5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide

5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide (PubChem CID 63860474) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide
PubChem CID63860474
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide
SMILESCC(C)Oc1ncccc1CNC(=O)c1cncc(O)c1
InChIInChI=1S/C15H17N3O3/c1-10(2)21-15-11(4-3-5-17-15)8-18-14(20)12-6-13(19)9-16-7-12/h3-7,9-10,19H,8H2,1-2H3,(H,18,20)
InChIKeyLICWIBNUMFWTSM-UHFFFAOYSA-N
XLogP1.90
TPSA84.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-1H-pyrazole-4-carboxamide
CID 60975328
N-[(3-ethyl-2-pyridinyl)methyl]-5-hydroxypyridine-3-carboxamide
CID 82739232
4-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 81229055
3-cyano-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]benzamide
CID 51082279
5-chloro-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyrazine-2-carboxamide
CID 107249436
5-(2-methylpropyl)-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-1H-pyrazole-3-carboxamide
CID 55742343
1-amino-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]cyclopropane-1-carboxamide
CID 65464946
N-[3-oxo-3-[(2-propan-2-yloxy-3-pyridinyl)methylamino]propyl]naphthalene-2-carboxamide
CID 55780723
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-1H-indazole-7-carboxamide
CID 47057623
N-[(2-bromophenyl)methyl]-5-hydroxypyridine-3-carboxamide
CID 63852378
4-methoxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]thiophene-2-carboxamide
CID 71982662
5-hydroxy-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 63864257

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide (CID 63860474) is 5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide is CC(C)Oc1ncccc1CNC(=O)c1cncc(O)c1.
What is the InChIKey of 5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide?
The InChIKey is LICWIBNUMFWTSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-10(2)21-15-11(4-3-5-17-15)8-18-14(20)12-6-13(19)9-16-7-12/h3-7,9-10,19H,8H2,1-2H3,(H,18,20).
What are the key properties of 5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide?
5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[(2-propan-2-yloxy-3-pyridinyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 63860474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).