N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide

C20H15Cl2N3O3 — CID 1010432

IUPACN-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide
SMILESCOc1cc(NC(=O)c2ccc(Cl)cc2)c(Cl)cc1NC(=O)c1cccnc1
InChIInChI=1S/C20H15Cl2N3O3/c1-28-18-10-16(24-19(26)12-4-6-14(21)7-5-12)15(22)9-17(18)25-20(27)13-3-2-8-23-11-13/h2-11H,1H3,(H,24,26)(H,25,27)
InChIKeyFJYUXKUMGHHTRO-UHFFFAOYSA-N
MW416.26 g/mol
LogP4.90
Rot. Bonds5

About N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide

N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide (PubChem CID 1010432) has the molecular formula C20H15Cl2N3O3 and a molecular weight of 416.26 g/mol. Its IUPAC name is N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide
PubChem CID1010432
Molecular FormulaC20H15Cl2N3O3
Molecular Weight416.26 g/mol
Exact Mass415.05
IUPAC NameN-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide
SMILESCOc1cc(NC(=O)c2ccc(Cl)cc2)c(Cl)cc1NC(=O)c1cccnc1
InChIInChI=1S/C20H15Cl2N3O3/c1-28-18-10-16(24-19(26)12-4-6-14(21)7-5-12)15(22)9-17(18)25-20(27)13-3-2-8-23-11-13/h2-11H,1H3,(H,24,26)(H,25,27)
InChIKeyFJYUXKUMGHHTRO-UHFFFAOYSA-N
XLogP4.90
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.26
LogP ≤ 54.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-amino-5-pyridin-3-yloxyphenyl)-3-chlorobenzamide
CID 811100
Alloswitch-1
CID 76853680
N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
CID 767774
N-[4-[[(2-chlorophenyl)-oxomethyl]amino]-3-methoxyphenyl]-2-pyridinecarboxamide
CID 46869940
3-chloro-N-(3-pyridin-3-yloxyphenyl)benzamide
CID 58337765
N-[4-(2-Chloro-benzoylamino)-3-methoxy-phenyl]-nicotinamide
CID 1088848
Cambridge id 5528777
CID 1367983
[(5-Chloro-2-methoxyphenyl)carbamoyl]methyl 6-chloropyridine-3-carboxylate
CID 2592239
2-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6-yl)-N-(3-methoxyphenyl)acetamide
CID 16021228
4-(8-chloro-5-oxopyrido[2,3-b][1,5]benzoxazepin-6(5H)-yl)-N-(4-methylbenzyl)butanamide
CID 16021344
N-{2-chloro-4-[(4-chlorobenzoyl)amino]-5-methoxyphenyl}nicotinamide
CID 1369114
Pyridine-2-carboxylic acid [4-(4-chloro-benzoylamino)-2,5-diethoxy-phenyl]-amide
CID 1441366

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide?
The IUPAC name of N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide (CID 1010432) is N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide is COc1cc(NC(=O)c2ccc(Cl)cc2)c(Cl)cc1NC(=O)c1cccnc1.
What is the InChIKey of N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide?
The InChIKey is FJYUXKUMGHHTRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2N3O3/c1-28-18-10-16(24-19(26)12-4-6-14(21)7-5-12)15(22)9-17(18)25-20(27)13-3-2-8-23-11-13/h2-11H,1H3,(H,24,26)(H,25,27).
What are the key properties of N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide?
N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide has a molecular weight of 416.26 g/mol, XLogP of 4.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-4-[(4-chlorobenzoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide is sourced from PubChem (CID 1010432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).