4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide

C24H19ClN4O2 — CID 157043679

IUPAC4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide
SMILESCc1nccc(Nc2ccc(C(=O)Nc3cccc(Oc4ccncc4)c3)cc2)c1Cl
InChIInChI=1S/C24H19ClN4O2/c1-16-23(25)22(11-14-27-16)28-18-7-5-17(6-8-18)24(30)29-19-3-2-4-21(15-19)31-20-9-12-26-13-10-20/h2-15H,1H3,(H,27,28)(H,29,30)
InChIKeyKZRXGPQEULAHFS-UHFFFAOYSA-N
MW430.90 g/mol
LogP6.23
Rot. Bonds6

About 4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide

4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide (PubChem CID 157043679) has the molecular formula C24H19ClN4O2 and a molecular weight of 430.90 g/mol. Its IUPAC name is 4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide.

Molecular Properties

Compound Name4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide
PubChem CID157043679
Molecular FormulaC24H19ClN4O2
Molecular Weight430.90 g/mol
Exact Mass430.12
IUPAC Name4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide
SMILESCc1nccc(Nc2ccc(C(=O)Nc3cccc(Oc4ccncc4)c3)cc2)c1Cl
InChIInChI=1S/C24H19ClN4O2/c1-16-23(25)22(11-14-27-16)28-18-7-5-17(6-8-18)24(30)29-19-3-2-4-21(15-19)31-20-9-12-26-13-10-20/h2-15H,1H3,(H,27,28)(H,29,30)
InChIKeyKZRXGPQEULAHFS-UHFFFAOYSA-N
XLogP6.23
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.90
LogP ≤ 56.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide 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

4-[(2-ethyl-3-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide
CID 170229291
3-[(6-fluoroquinolin-4-yl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide
CID 157042860
N-[4-[3-[4-(pyridine-4-carbonylamino)phenoxy]phenoxy]phenyl]pyridine-4-carboxamide
CID 1376699
4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-[4-[(2-methyl-4-pyridinyl)amino]-2-pyridinyl]benzamide;ethane
CID 157043483
4-methyl-N-(3-phenoxyphenyl)benzamide
CID 59304535
4-chloro-N-(3-pyrimidin-2-yloxyphenyl)benzamide
CID 39262452
N-(4-pyridin-4-yloxyphenyl)-3-(quinolin-4-ylamino)benzamide
CID 166832857
3-[(6-cyanoquinolin-4-yl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide
CID 157043187
4-[(2-methyl-4-pyridinyl)amino]-N-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]benzamide
CID 157044209
4-[(6-fluoroquinolin-4-yl)amino]-N-methyl-N-(3-pyridin-4-yloxyphenyl)benzamide
CID 170228480
N-(3-chloro-4-fluorophenyl)-3-pyridin-4-yloxybenzamide
CID 91103914
tert-butyl N-[3-[(3-pyridin-4-yloxyphenyl)carbamoyl]phenyl]carbamate
CID 157042654

Frequently Asked Questions

What is the IUPAC name of 4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide?
The IUPAC name of 4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide (CID 157043679) is 4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide.
What is the SMILES notation for 4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide?
The canonical SMILES for 4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide is Cc1nccc(Nc2ccc(C(=O)Nc3cccc(Oc4ccncc4)c3)cc2)c1Cl.
What is the InChIKey of 4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide?
The InChIKey is KZRXGPQEULAHFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19ClN4O2/c1-16-23(25)22(11-14-27-16)28-18-7-5-17(6-8-18)24(30)29-19-3-2-4-21(15-19)31-20-9-12-26-13-10-20/h2-15H,1H3,(H,27,28)(H,29,30).
What are the key properties of 4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide?
4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide has a molecular weight of 430.90 g/mol, XLogP of 6.23, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-chloro-2-methyl-4-pyridinyl)amino]-N-(3-pyridin-4-yloxyphenyl)benzamide is sourced from PubChem (CID 157043679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).