5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide

C17H21N3O2 — CID 109222894

IUPAC5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1cncc(Nc2cc(C)ccc2OC)c1
InChIInChI=1S/C17H21N3O2/c1-4-7-19-17(21)13-9-14(11-18-10-13)20-15-8-12(2)5-6-16(15)22-3/h5-6,8-11,20H,4,7H2,1-3H3,(H,19,21)
InChIKeyRHFYQJOCXJCAJE-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.28
Rot. Bonds6

About 5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide

5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide (PubChem CID 109222894) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is 5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide
PubChem CID109222894
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1cncc(Nc2cc(C)ccc2OC)c1
InChIInChI=1S/C17H21N3O2/c1-4-7-19-17(21)13-9-14(11-18-10-13)20-15-8-12(2)5-6-16(15)22-3/h5-6,8-11,20H,4,7H2,1-3H3,(H,19,21)
InChIKeyRHFYQJOCXJCAJE-UHFFFAOYSA-N
XLogP3.28
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
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-(3-chlorophenyl)ethyl]-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109241150
N-[2-(cyclohexen-1-yl)ethyl]-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109227459
5-N-(2-methoxy-5-methylphenyl)-3-N-propylpyridine-3,5-diamine
CID 104532272
N-(4-chlorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109244574
N-(4-fluorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109244246
5-(butylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109224665
N-(3-fluorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109245541
N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109245547
[5-(2-methoxy-5-methylanilino)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109225626
N-butyl-5-(3,4-dimethoxyanilino)pyridine-3-carboxamide
CID 109224477
N-butyl-5-(4-chloro-2,5-dimethoxyanilino)pyridine-3-carboxamide
CID 109224522
N-[3-(dimethylamino)propyl]-5-(2,5-dimethylanilino)pyridine-3-carboxamide
CID 109229797

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide?
The IUPAC name of 5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide (CID 109222894) is 5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide?
The canonical SMILES for 5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide is CCCNC(=O)c1cncc(Nc2cc(C)ccc2OC)c1.
What is the InChIKey of 5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide?
The InChIKey is RHFYQJOCXJCAJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-4-7-19-17(21)13-9-14(11-18-10-13)20-15-8-12(2)5-6-16(15)22-3/h5-6,8-11,20H,4,7H2,1-3H3,(H,19,21).
What are the key properties of 5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide?
5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide has a molecular weight of 299.37 g/mol, XLogP of 3.28, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxy-5-methylanilino)-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 109222894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).