N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide

C26H22N4O4 — CID 2852997

IUPACN-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide
SMILESCOc1cc(-c2ccc(NC(=O)c3cccnc3)c(OC)c2)ccc1NC(=O)c1cccnc1
InChIInChI=1S/C26H22N4O4/c1-33-23-13-17(7-9-21(23)29-25(31)19-5-3-11-27-15-19)18-8-10-22(24(14-18)34-2)30-26(32)20-6-4-12-28-16-20/h3-16H,1-2H3,(H,29,31)(H,30,32)
InChIKeyNGRWCATZNLCGAW-UHFFFAOYSA-N
MW454.49 g/mol
LogP4.67
Rot. Bonds7

About N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide

N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide (PubChem CID 2852997) has the molecular formula C26H22N4O4 and a molecular weight of 454.49 g/mol. Its IUPAC name is N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide
PubChem CID2852997
Molecular FormulaC26H22N4O4
Molecular Weight454.49 g/mol
Exact Mass454.16
IUPAC NameN-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide
SMILESCOc1cc(-c2ccc(NC(=O)c3cccnc3)c(OC)c2)ccc1NC(=O)c1cccnc1
InChIInChI=1S/C26H22N4O4/c1-33-23-13-17(7-9-21(23)29-25(31)19-5-3-11-27-15-19)18-8-10-22(24(14-18)34-2)30-26(32)20-6-4-12-28-16-20/h3-16H,1-2H3,(H,29,31)(H,30,32)
InChIKeyNGRWCATZNLCGAW-UHFFFAOYSA-N
XLogP4.67
TPSA102.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.49
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxy-4,5-dimethylphenyl)pyridine-3-carboxamide
CID 110776826
N-(2,5-dichloro-4-methoxyphenyl)pyridine-3-carboxamide;hydrochloride
CID 110777674
N-[2-[(2,4-dimethoxyphenyl)carbamoyl]-4-iodophenyl]pyridine-3-carboxamide
CID 4236542
N-(2,4-dimethoxy-3-methylphenyl)pyridine-3-carboxamide
CID 110777868
N-[2-methoxy-4-(pentanoylamino)phenyl]pyridine-3-carboxamide
CID 38661659
N-[4-[(2-amino-3-methylbutanoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide
CID 119845805
3-bromo-N-[4-[4-[(3-bromobenzoyl)amino]-3-methoxyphenyl]-2-methoxyphenyl]benzamide
CID 4030037
N-[2-methoxy-4-[[2-(4-methylphenyl)sulfanylacetyl]amino]phenyl]pyridine-3-carboxamide
CID 33491810
N-[2-methoxy-4-[[2-methyl-3-(methylamino)propanoyl]amino]phenyl]pyridine-3-carboxamide;dihydrochloride
CID 119845814
N-[2-cyano-3-(3,4-dimethoxyphenyl)phenyl]pyridine-3-carboxamide
CID 155019311
N-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]-2-oxo-1H-pyridine-3-carboxamide
CID 38659868
N-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]quinoline-2-carboxamide
CID 38661634

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide (CID 2852997) is N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide is COc1cc(-c2ccc(NC(=O)c3cccnc3)c(OC)c2)ccc1NC(=O)c1cccnc1.
What is the InChIKey of N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide?
The InChIKey is NGRWCATZNLCGAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N4O4/c1-33-23-13-17(7-9-21(23)29-25(31)19-5-3-11-27-15-19)18-8-10-22(24(14-18)34-2)30-26(32)20-6-4-12-28-16-20/h3-16H,1-2H3,(H,29,31)(H,30,32).
What are the key properties of N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide?
N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide has a molecular weight of 454.49 g/mol, XLogP of 4.67, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 2852997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).