6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide

C22H23N3O2 — CID 109162323

IUPAC6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
SMILESCC(C)Oc1ccc(NC(=O)c2ccc(N(C)c3ccccc3)nc2)cc1
InChIInChI=1S/C22H23N3O2/c1-16(2)27-20-12-10-18(11-13-20)24-22(26)17-9-14-21(23-15-17)25(3)19-7-5-4-6-8-19/h4-16H,1-3H3,(H,24,26)
InChIKeyYGEWWBLEMINYPJ-UHFFFAOYSA-N
MW361.45 g/mol
LogP4.89
Rot. Bonds6

About 6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide

6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide (PubChem CID 109162323) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
PubChem CID109162323
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC Name6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
SMILESCC(C)Oc1ccc(NC(=O)c2ccc(N(C)c3ccccc3)nc2)cc1
InChIInChI=1S/C22H23N3O2/c1-16(2)27-20-12-10-18(11-13-20)24-22(26)17-9-14-21(23-15-17)25(3)19-7-5-4-6-8-19/h4-16H,1-3H3,(H,24,26)
InChIKeyYGEWWBLEMINYPJ-UHFFFAOYSA-N
XLogP4.89
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dimethoxyphenyl)-6-(N-methylanilino)pyridine-3-carboxamide
CID 109162326
N-[3-(2-anilino-2-oxoethoxy)phenyl]-6-(N-methylanilino)pyridine-3-carboxamide
CID 112846287
N-(2,4-dimethoxyphenyl)-6-(N-methylanilino)pyridine-3-carboxamide
CID 109162325
(2R)-3-methyl-2-[[6-(N-methylanilino)pyridine-3-carbonyl]amino]butanoic acid
CID 119368692
6-hydrazinyl-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 62241267
6-(N-methylanilino)pyridine-3-carboxylic acid
CID 16778360
N-methyl-N-phenyl-2-(4-propan-2-yloxyanilino)pyrimidine-5-carboxamide
CID 109265906
4-(methylamino)-N-(4-propan-2-yloxyphenyl)benzamide
CID 62166478
3-methyl-4-[[6-(N-methylanilino)pyridine-3-carbonyl]amino]butanoic acid
CID 120537159
N-[6-(N-methylanilino)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide
CID 113016484
N-[4-(dimethylamino)phenyl]-6-propan-2-yloxypyridine-3-carboxamide
CID 86985414
4-amino-N-(4-propan-2-yloxyphenyl)benzamide
CID 28722589

Frequently Asked Questions

What is the IUPAC name of 6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide (CID 109162323) is 6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide is CC(C)Oc1ccc(NC(=O)c2ccc(N(C)c3ccccc3)nc2)cc1.
What is the InChIKey of 6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
The InChIKey is YGEWWBLEMINYPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-16(2)27-20-12-10-18(11-13-20)24-22(26)17-9-14-21(23-15-17)25(3)19-7-5-4-6-8-19/h4-16H,1-3H3,(H,24,26).
What are the key properties of 6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide?
6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide has a molecular weight of 361.45 g/mol, XLogP of 4.89, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109162323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).