N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide

C16H19N3O2 — CID 109183906

IUPACN-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide
SMILESCOCCNC(=O)c1ccc(Nc2ccc(C)cc2)cn1
InChIInChI=1S/C16H19N3O2/c1-12-3-5-13(6-4-12)19-14-7-8-15(18-11-14)16(20)17-9-10-21-2/h3-8,11,19H,9-10H2,1-2H3,(H,17,20)
InChIKeyGBLJRVANYOFCHA-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.51
Rot. Bonds6

About N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide

N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide (PubChem CID 109183906) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide
PubChem CID109183906
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide
SMILESCOCCNC(=O)c1ccc(Nc2ccc(C)cc2)cn1
InChIInChI=1S/C16H19N3O2/c1-12-3-5-13(6-4-12)19-14-7-8-15(18-11-14)16(20)17-9-10-21-2/h3-8,11,19H,9-10H2,1-2H3,(H,17,20)
InChIKeyGBLJRVANYOFCHA-UHFFFAOYSA-N
XLogP2.51
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)-5-(4-propan-2-ylanilino)pyridine-2-carboxamide
CID 109183921
5-(3-chloro-4-methylanilino)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109183935
5-(4-bromoanilino)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109184307
5-(2-fluoroanilino)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109183927
5-(4-bromo-2-methylanilino)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109183979
5-(4-methylanilino)-N-prop-2-enylpyridine-2-carboxamide
CID 109180319
N-(2-methoxyethyl)-5-(3-methylbutylamino)pyridine-2-carboxamide
CID 109183892
N-(2-methoxyethyl)-5-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109183920
methyl 4-[[6-(propylcarbamoyl)-3-pyridinyl]amino]benzoate
CID 109179188
N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide
CID 109184195
5-(3-bromoanilino)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109184344
5-bromo-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 62954201

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide (CID 109183906) is N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide is COCCNC(=O)c1ccc(Nc2ccc(C)cc2)cn1.
What is the InChIKey of N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide?
The InChIKey is GBLJRVANYOFCHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-12-3-5-13(6-4-12)19-14-7-8-15(18-11-14)16(20)17-9-10-21-2/h3-8,11,19H,9-10H2,1-2H3,(H,17,20).
What are the key properties of N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide?
N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-5-(4-methylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109183906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).