N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide

C22H23N3O3 — CID 109221648

IUPACN-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(Nc3ccc(OC(C)C)cc3)ccn2)cc1
InChIInChI=1S/C22H23N3O3/c1-15(2)28-20-10-6-16(7-11-20)24-18-12-13-23-21(14-18)22(26)25-17-4-8-19(27-3)9-5-17/h4-15H,1-3H3,(H,23,24)(H,25,26)
InChIKeyBQZMVAHQDZGBJM-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.87
Rot. Bonds7

About N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide

N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide (PubChem CID 109221648) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide
PubChem CID109221648
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(Nc3ccc(OC(C)C)cc3)ccn2)cc1
InChIInChI=1S/C22H23N3O3/c1-15(2)28-20-10-6-16(7-11-20)24-18-12-13-23-21(14-18)22(26)25-17-4-8-19(27-3)9-5-17/h4-15H,1-3H3,(H,23,24)(H,25,26)
InChIKeyBQZMVAHQDZGBJM-UHFFFAOYSA-N
XLogP4.87
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-methoxyanilino)-N-(4-propan-2-yloxyphenyl)pyridine-2-carboxamide
CID 109221601
N-(4-methoxyphenyl)-4-[4-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109221654
4-(3-chloroanilino)-N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 109220984
N-(4-methoxyphenyl)-4-(methylamino)pyridine-2-carboxamide
CID 55042638
4-(2-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-2-carboxamide
CID 109219027
N-(3-methoxypropyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide
CID 109206146
N-butan-2-yl-4-(4-methoxyanilino)pyridine-2-carboxamide
CID 109203359
N-cycloheptyl-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide
CID 109217095
4-(2,5-dichloroanilino)-N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 109221676
N-(2-fluorophenyl)-4-(4-methoxyanilino)pyridine-2-carboxamide
CID 109220605
4-(3-methoxyanilino)-N-phenylpyridine-2-carboxamide
CID 109218773
4-(3-methoxyanilino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109219226

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide (CID 109221648) is N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide is COc1ccc(NC(=O)c2cc(Nc3ccc(OC(C)C)cc3)ccn2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide?
The InChIKey is BQZMVAHQDZGBJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-15(2)28-20-10-6-16(7-11-20)24-18-12-13-23-21(14-18)22(26)25-17-4-8-19(27-3)9-5-17/h4-15H,1-3H3,(H,23,24)(H,25,26).
What are the key properties of N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide?
N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide has a molecular weight of 377.44 g/mol, XLogP of 4.87, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109221648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).