N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide

C19H16BrN3O2 — CID 109199748

IUPACN-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide
SMILESCOc1ccccc1Nc1ccc(C(=O)Nc2cccc(Br)c2)nc1
InChIInChI=1S/C19H16BrN3O2/c1-25-18-8-3-2-7-16(18)22-15-9-10-17(21-12-15)19(24)23-14-6-4-5-13(20)11-14/h2-12,22H,1H3,(H,23,24)
InChIKeyHIMYRCXNXXIWIE-UHFFFAOYSA-N
MW398.26 g/mol
LogP4.85
Rot. Bonds5

About N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide

N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide (PubChem CID 109199748) has the molecular formula C19H16BrN3O2 and a molecular weight of 398.26 g/mol. Its IUPAC name is N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide
PubChem CID109199748
Molecular FormulaC19H16BrN3O2
Molecular Weight398.26 g/mol
Exact Mass397.04
IUPAC NameN-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide
SMILESCOc1ccccc1Nc1ccc(C(=O)Nc2cccc(Br)c2)nc1
InChIInChI=1S/C19H16BrN3O2/c1-25-18-8-3-2-7-16(18)22-15-9-10-17(21-12-15)19(24)23-14-6-4-5-13(20)11-14/h2-12,22H,1H3,(H,23,24)
InChIKeyHIMYRCXNXXIWIE-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

N-(3-chloro-4-methoxyphenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide
CID 109199580
5-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199779
N-(3-acetylphenyl)-5-(2,4-dimethoxyanilino)pyridine-2-carboxamide
CID 109200228
N-(3-acetylphenyl)-5-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide
CID 109199643
3-bromo-N-[6-(2-methoxyanilino)-3-pyridinyl]benzamide
CID 113019293
N-(3-acetylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109199996
methyl 2-[[5-(2-methoxyanilino)pyridine-2-carbonyl]amino]benzoate
CID 109199740
N-(3-bromophenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide
CID 109179798
5-(3-bromoanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 109198855
2-(3-bromoanilino)-N-(2-methoxyphenyl)pyrimidine-5-carboxamide
CID 109269426
methyl 3-[[5-(2-chloroanilino)pyridine-2-carbonyl]amino]benzoate
CID 109199140
5-(2-methoxyanilino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109199751

Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide?
The IUPAC name of N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide (CID 109199748) is N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide is COc1ccccc1Nc1ccc(C(=O)Nc2cccc(Br)c2)nc1.
What is the InChIKey of N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide?
The InChIKey is HIMYRCXNXXIWIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16BrN3O2/c1-25-18-8-3-2-7-16(18)22-15-9-10-17(21-12-15)19(24)23-14-6-4-5-13(20)11-14/h2-12,22H,1H3,(H,23,24).
What are the key properties of N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide?
N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-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 N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109199748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).