4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide

C17H21N3O2 — CID 109201419

IUPAC4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide
SMILESCOc1ccc(C)cc1Nc1ccnc(C(=O)NC(C)C)c1
InChIInChI=1S/C17H21N3O2/c1-11(2)19-17(21)15-10-13(7-8-18-15)20-14-9-12(3)5-6-16(14)22-4/h5-11H,1-4H3,(H,18,20)(H,19,21)
InChIKeyUIOVSSQJRVIDTG-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.28
Rot. Bonds5

About 4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide

4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide (PubChem CID 109201419) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is 4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide
PubChem CID109201419
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide
SMILESCOc1ccc(C)cc1Nc1ccnc(C(=O)NC(C)C)c1
InChIInChI=1S/C17H21N3O2/c1-11(2)19-17(21)15-10-13(7-8-18-15)20-14-9-12(3)5-6-16(14)22-4/h5-11H,1-4H3,(H,18,20)(H,19,21)
InChIKeyUIOVSSQJRVIDTG-UHFFFAOYSA-N
XLogP3.28
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-dimethylphenyl)-4-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109219739
N-(4-acetamidophenyl)-4-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109221888
4-(5-chloro-2-methoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109221419
4-(2-methoxy-5-methylanilino)-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
CID 109221903
N-(2-methoxy-5-methylphenyl)-4-(3-methylanilino)pyridine-2-carboxamide
CID 109219162
4-(4-acetamidoanilino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109221861
4-(3-chloro-4-methoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109221381
N-[(2-chlorophenyl)methyl]-4-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109211667
N-[2-(2-fluorophenyl)ethyl]-4-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109213989
4-(2-cyanoanilino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109221872
N-[2-(3-chlorophenyl)ethyl]-4-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109218487
4-(tert-butylamino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109217002

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide?
The IUPAC name of 4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide (CID 109201419) is 4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide.
What is the SMILES notation for 4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide?
The canonical SMILES for 4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide is COc1ccc(C)cc1Nc1ccnc(C(=O)NC(C)C)c1.
What is the InChIKey of 4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide?
The InChIKey is UIOVSSQJRVIDTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-11(2)19-17(21)15-10-13(7-8-18-15)20-14-9-12(3)5-6-16(14)22-4/h5-11H,1-4H3,(H,18,20)(H,19,21).
What are the key properties of 4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide?
4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide has a molecular weight of 299.37 g/mol, XLogP of 3.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxy-5-methylanilino)-N-propan-2-ylpyridine-2-carboxamide is sourced from PubChem (CID 109201419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).