N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide

C24H24N4O4 — CID 33492420

IUPACN-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide
SMILESCOc1cc(NC(=O)CCCNC(=O)c2ccccc2)ccc1NC(=O)c1cccnc1
InChIInChI=1S/C24H24N4O4/c1-32-21-15-19(11-12-20(21)28-24(31)18-9-5-13-25-16-18)27-22(29)10-6-14-26-23(30)17-7-3-2-4-8-17/h2-5,7-9,11-13,15-16H,6,10,14H2,1H3,(H,26,30)(H,27,29)(H,28,31)
InChIKeyHMZAZNHDNHGTGD-UHFFFAOYSA-N
MW432.48 g/mol
LogP3.49
Rot. Bonds9

About N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide

N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide (PubChem CID 33492420) has the molecular formula C24H24N4O4 and a molecular weight of 432.48 g/mol. Its IUPAC name is N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide
PubChem CID33492420
Molecular FormulaC24H24N4O4
Molecular Weight432.48 g/mol
Exact Mass432.18
IUPAC NameN-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide
SMILESCOc1cc(NC(=O)CCCNC(=O)c2ccccc2)ccc1NC(=O)c1cccnc1
InChIInChI=1S/C24H24N4O4/c1-32-21-15-19(11-12-20(21)28-24(31)18-9-5-13-25-16-18)27-22(29)10-6-14-26-23(30)17-7-3-2-4-8-17/h2-5,7-9,11-13,15-16H,6,10,14H2,1H3,(H,26,30)(H,27,29)(H,28,31)
InChIKeyHMZAZNHDNHGTGD-UHFFFAOYSA-N
XLogP3.49
TPSA109.42 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.48
LogP ≤ 53.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-methoxy-4-(pentanoylamino)phenyl]pyridine-3-carboxamide
CID 38661659
N-[2-methoxy-4-[3-(3,4,5-trimethoxyphenyl)propanoylamino]phenyl]pyridine-3-carboxamide
CID 33497824
N-[4-[3-[(2-chloro-4-fluorobenzoyl)amino]propanoylamino]-2-methoxyphenyl]pyridine-3-carboxamide
CID 55760803
N-[2-methoxy-4-[[2-(2-methylphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 38661253
N-[4-oxo-4-(pyridin-3-ylamino)butyl]benzamide
CID 39761141
N-[4-[3-(4-cyanophenyl)propanoylamino]-2-methoxyphenyl]pyridine-3-carboxamide
CID 33494417
N-[4-[[2-[(5-bromofuran-2-carbonyl)amino]acetyl]amino]-2-methoxyphenyl]pyridine-3-carboxamide
CID 38660436
N-[4-(2-methoxyanilino)-4-oxobutyl]benzamide
CID 29371184
N-[2-methoxy-4-[[2-(4-methylphenyl)sulfanylacetyl]amino]phenyl]pyridine-3-carboxamide
CID 33491810
N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide
CID 33492536
N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide
CID 2852997
N-[4-[[2-[[2-(1-adamantyl)acetyl]amino]acetyl]amino]-2-methoxyphenyl]pyridine-3-carboxamide
CID 55653506

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide?
The IUPAC name of N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide (CID 33492420) is N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide is COc1cc(NC(=O)CCCNC(=O)c2ccccc2)ccc1NC(=O)c1cccnc1.
What is the InChIKey of N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide?
The InChIKey is HMZAZNHDNHGTGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O4/c1-32-21-15-19(11-12-20(21)28-24(31)18-9-5-13-25-16-18)27-22(29)10-6-14-26-23(30)17-7-3-2-4-8-17/h2-5,7-9,11-13,15-16H,6,10,14H2,1H3,(H,26,30)(H,27,29)(H,28,31).
What are the key properties of N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide?
N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide has a molecular weight of 432.48 g/mol, XLogP of 3.49, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide is sourced from PubChem (CID 33492420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).