N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide

C12H14N4O — CID 35283696

IUPACN-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide
SMILESCc1nn(C)c(C)c1NC(=O)c1ccncc1
InChIInChI=1S/C12H14N4O/c1-8-11(9(2)16(3)15-8)14-12(17)10-4-6-13-7-5-10/h4-7H,1-3H3,(H,14,17)
InChIKeyAUVJHMRJRGCUJN-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.68
Rot. Bonds2

About N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide

N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide (PubChem CID 35283696) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide
PubChem CID35283696
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC NameN-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide
SMILESCc1nn(C)c(C)c1NC(=O)c1ccncc1
InChIInChI=1S/C12H14N4O/c1-8-11(9(2)16(3)15-8)14-12(17)10-4-6-13-7-5-10/h4-7H,1-3H3,(H,14,17)
InChIKeyAUVJHMRJRGCUJN-UHFFFAOYSA-N
XLogP1.68
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
CID 692973
3-chloro-4-iodo-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
CID 103734754
5-methyl-N-(1,3,5-trimethylpyrazol-4-yl)thiophene-2-carboxamide
CID 30698931
3-pyrrol-1-yl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
CID 38105280
N-(2,6-dimethylphenyl)pyridine-4-carboxamide;hydrochloride
CID 110756385
4-morpholin-4-ylsulfonyl-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
CID 8894997
3-methyl-4-nitro-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
CID 9247878
6-chloro-N-(1,3,5-trimethylpyrazol-4-yl)pyrazine-2-carboxamide
CID 103336954
N-(2-methylpyrazol-3-yl)pyridine-4-carboxamide
CID 110471287
N-[3-[(5-bromo-1,3-dimethylpyrazole-4-carbonyl)amino]phenyl]pyridine-4-carboxamide
CID 100743130
3-amino-N-(1,3,5-trimethylpyrazol-4-yl)-1H-pyrazole-5-carboxamide
CID 64524039
4-[(4-methoxyanilino)methyl]-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
CID 90786427

Frequently Asked Questions

What is the IUPAC name of N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide?
The IUPAC name of N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide (CID 35283696) is N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide.
What is the SMILES notation for N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide?
The canonical SMILES for N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide is Cc1nn(C)c(C)c1NC(=O)c1ccncc1.
What is the InChIKey of N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide?
The InChIKey is AUVJHMRJRGCUJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-8-11(9(2)16(3)15-8)14-12(17)10-4-6-13-7-5-10/h4-7H,1-3H3,(H,14,17).
What are the key properties of N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide?
N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide has a molecular weight of 230.27 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-carboxamide is sourced from PubChem (CID 35283696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).