N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide

C19H16N4O2 — CID 108926411

IUPACN-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide
SMILESO=C(NCc1cccc(NC(=O)c2cccnc2)c1)c1ccncc1
InChIInChI=1S/C19H16N4O2/c24-18(15-6-9-20-10-7-15)22-12-14-3-1-5-17(11-14)23-19(25)16-4-2-8-21-13-16/h1-11,13H,12H2,(H,22,24)(H,23,25)
InChIKeyHIRARMFTNZOORL-UHFFFAOYSA-N
MW332.36 g/mol
LogP2.66
Rot. Bonds5

About N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide

N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide (PubChem CID 108926411) has the molecular formula C19H16N4O2 and a molecular weight of 332.36 g/mol. Its IUPAC name is N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide
PubChem CID108926411
Molecular FormulaC19H16N4O2
Molecular Weight332.36 g/mol
Exact Mass332.13
IUPAC NameN-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide
SMILESO=C(NCc1cccc(NC(=O)c2cccnc2)c1)c1ccncc1
InChIInChI=1S/C19H16N4O2/c24-18(15-6-9-20-10-7-15)22-12-14-3-1-5-17(11-14)23-19(25)16-4-2-8-21-13-16/h1-11,13H,12H2,(H,22,24)(H,23,25)
InChIKeyHIRARMFTNZOORL-UHFFFAOYSA-N
XLogP2.66
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-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

N-[3-(benzamidomethyl)phenyl]pyridine-4-carboxamide
CID 166187411
N-[3-[[(4-tert-butylbenzoyl)amino]methyl]phenyl]pyridine-3-carboxamide
CID 108926353
N-[3-[[(2-phenylacetyl)amino]methyl]phenyl]pyridine-3-carboxamide
CID 108926276
N-[3-[(thiophene-2-carbonylamino)methyl]phenyl]pyridine-3-carboxamide
CID 108926382
N-[[3-(propanoylamino)phenyl]methyl]pyridine-3-carboxamide
CID 108926394
ethyl [4-[[3-[(pyridine-3-carbonylamino)methyl]phenyl]carbamoyl]phenyl] carbonate
CID 108926226
N-[3-[[(2-thiophen-2-ylacetyl)amino]methyl]phenyl]pyridine-3-carboxamide
CID 108926355
N-[[3-[(2,3,4-trifluorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108926408
N-[3-[(3-methoxypropanoylamino)methyl]phenyl]pyridine-3-carboxamide
CID 108926397
N-[3-[(pyridin-3-ylmethylamino)methyl]phenyl]benzamide
CID 167788659
5-N-(3-acetylphenyl)-3-N-(pyridin-3-ylmethyl)pyridine-3,5-dicarboxamide
CID 109106065
N-[[3-[(2-cyclohexylideneacetyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108926549

Frequently Asked Questions

What is the IUPAC name of N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide (CID 108926411) is N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide is O=C(NCc1cccc(NC(=O)c2cccnc2)c1)c1ccncc1.
What is the InChIKey of N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide?
The InChIKey is HIRARMFTNZOORL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O2/c24-18(15-6-9-20-10-7-15)22-12-14-3-1-5-17(11-14)23-19(25)16-4-2-8-21-13-16/h1-11,13H,12H2,(H,22,24)(H,23,25).
What are the key properties of N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide?
N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide has a molecular weight of 332.36 g/mol, XLogP of 2.66, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 108926411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).