6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide

C19H16BrN3O2 — CID 109163910

IUPAC6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccccc1NC(=O)c1ccc(Nc2ccccc2Br)nc1
InChIInChI=1S/C19H16BrN3O2/c1-25-17-9-5-4-8-16(17)23-19(24)13-10-11-18(21-12-13)22-15-7-3-2-6-14(15)20/h2-12H,1H3,(H,21,22)(H,23,24)
InChIKeyGUXBPGMDJZTISV-UHFFFAOYSA-N
MW398.26 g/mol
LogP4.85
Rot. Bonds5

About 6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide

6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide (PubChem CID 109163910) has the molecular formula C19H16BrN3O2 and a molecular weight of 398.26 g/mol. Its IUPAC name is 6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
PubChem CID109163910
Molecular FormulaC19H16BrN3O2
Molecular Weight398.26 g/mol
Exact Mass397.04
IUPAC Name6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccccc1NC(=O)c1ccc(Nc2ccccc2Br)nc1
InChIInChI=1S/C19H16BrN3O2/c1-25-17-9-5-4-8-16(17)23-19(24)13-10-11-18(21-12-13)22-15-7-3-2-6-14(15)20/h2-12H,1H3,(H,21,22)(H,23,24)
InChIKeyGUXBPGMDJZTISV-UHFFFAOYSA-N
XLogP4.85
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.26
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[[5-[(2-methoxyphenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109163904
N-(5-chloro-2-methoxyphenyl)-6-(2-methoxyanilino)pyridine-3-carboxamide
CID 109163811
methyl 4-[[6-(2-methoxyanilino)pyridine-3-carbonyl]amino]benzoate
CID 109163865
2-N,5-N-bis(2-methoxyphenyl)pyridine-2,5-dicarboxamide
CID 1369664
N-(4-chlorophenyl)-6-(2-methoxyanilino)pyridine-3-carboxamide
CID 109163500
N-(2-methoxyphenyl)-6-methylpyridine-3-carboxamide
CID 18148000
6-(2-methoxy-5-methylanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109164204
N-(2-bromophenyl)-6-(2-cyanoanilino)pyridine-3-carboxamide
CID 109164779
6-(2-chloroanilino)-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
CID 109163334
6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109164093
5-[(2-methoxyphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 15121191
methyl N-[6-(2-bromoanilino)-3-pyridinyl]carbamate
CID 113021397

Frequently Asked Questions

What is the IUPAC name of 6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide (CID 109163910) is 6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide is COc1ccccc1NC(=O)c1ccc(Nc2ccccc2Br)nc1.
What is the InChIKey of 6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The InChIKey is GUXBPGMDJZTISV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16BrN3O2/c1-25-17-9-5-4-8-16(17)23-19(24)13-10-11-18(21-12-13)22-15-7-3-2-6-14(15)20/h2-12H,1H3,(H,21,22)(H,23,24).
What are the key properties of 6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide has a molecular weight of 398.26 g/mol, XLogP of 4.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-bromoanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109163910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).