N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide

C11H12N4O — CID 35523459

IUPACN-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide
SMILESCn1cc(CNC(=O)c2ccncc2)cn1
InChIInChI=1S/C11H12N4O/c1-15-8-9(7-14-15)6-13-11(16)10-2-4-12-5-3-10/h2-5,7-8H,6H2,1H3,(H,13,16)
InChIKeyGHVGTNZZGSIJBE-UHFFFAOYSA-N
MW216.24 g/mol
LogP0.75
Rot. Bonds3

About N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide

N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide (PubChem CID 35523459) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide
PubChem CID35523459
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC NameN-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide
SMILESCn1cc(CNC(=O)c2ccncc2)cn1
InChIInChI=1S/C11H12N4O/c1-15-8-9(7-14-15)6-13-11(16)10-2-4-12-5-3-10/h2-5,7-8H,6H2,1H3,(H,13,16)
InChIKeyGHVGTNZZGSIJBE-UHFFFAOYSA-N
XLogP0.75
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-4-carboxamide
CID 19474553
4-(dimethylamino)-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 47375355
4-cyano-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 61343888
5-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
CID 63861037
3-methyl-N-[(1-methylpyrazol-4-yl)methyl]benzimidazole-5-carboxamide
CID 110469163
3-bromo-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 19292435
3-hydroxy-4-iodo-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 113434699
4-(1,5-dimethyl-1,2,4-triazol-3-yl)-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 122561579
N-[(1-methyl-6-oxo-3-pyridinyl)methyl]pyridine-4-carboxamide
CID 110730530
3-(dimethylamino)-N-[(1-methylpyrazol-4-yl)methyl]benzamide
CID 47375354
4-fluoro-N-[(1-methylpyrazol-4-yl)methyl]-3-sulfanylbenzamide
CID 107027465
N-[[3-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-5-yl]methyl]pyridine-4-carboxamide
CID 119104925

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide?
The IUPAC name of N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide (CID 35523459) is N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide?
The canonical SMILES for N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide is Cn1cc(CNC(=O)c2ccncc2)cn1.
What is the InChIKey of N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide?
The InChIKey is GHVGTNZZGSIJBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c1-15-8-9(7-14-15)6-13-11(16)10-2-4-12-5-3-10/h2-5,7-8H,6H2,1H3,(H,13,16).
What are the key properties of N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide?
N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide has a molecular weight of 216.24 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 35523459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).