5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide

C13H16N4O2 — CID 79038700

IUPAC5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide
SMILESCc1nn(C)c(C)c1CNC(=O)c1cncc(O)c1
InChIInChI=1S/C13H16N4O2/c1-8-12(9(2)17(3)16-8)7-15-13(19)10-4-11(18)6-14-5-10/h4-6,18H,7H2,1-3H3,(H,15,19)
InChIKeyOIZDLWQMZCQMLZ-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.07
Rot. Bonds3

About 5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide

5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide (PubChem CID 79038700) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide
PubChem CID79038700
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide
SMILESCc1nn(C)c(C)c1CNC(=O)c1cncc(O)c1
InChIInChI=1S/C13H16N4O2/c1-8-12(9(2)17(3)16-8)7-15-13(19)10-4-11(18)6-14-5-10/h4-6,18H,7H2,1-3H3,(H,15,19)
InChIKeyOIZDLWQMZCQMLZ-UHFFFAOYSA-N
XLogP1.07
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-dimethoxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]benzamide
CID 19282242
4-iodo-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]benzamide
CID 79036409
N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazine-2-carboxamide
CID 35525163
5-iodo-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiophene-3-carboxamide
CID 79036410
4-(dimethylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]benzamide
CID 110444483
2-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide
CID 79237744
2-chloro-6-(methylamino)-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-4-carboxamide
CID 79036395
2-hydroxy-5-iodo-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]benzamide
CID 103713370
4-amino-3-methoxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]benzamide
CID 104783069
3-amino-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-1H-pyrazole-5-carboxamide
CID 79225452
5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide
CID 115621996
methyl N-[(1,3,5-trimethylpyrazol-4-yl)methyl]carbamate
CID 110731133

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide (CID 79038700) is 5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide is Cc1nn(C)c(C)c1CNC(=O)c1cncc(O)c1.
What is the InChIKey of 5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide?
The InChIKey is OIZDLWQMZCQMLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-8-12(9(2)17(3)16-8)7-15-13(19)10-4-11(18)6-14-5-10/h4-6,18H,7H2,1-3H3,(H,15,19).
What are the key properties of 5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide?
5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide has a molecular weight of 260.30 g/mol, XLogP of 1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 79038700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).