5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide

C19H23N3O2 — CID 109106923

IUPAC5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1cncc(C(=O)NC(C)(C)C)c1
InChIInChI=1S/C19H23N3O2/c1-5-13-8-6-7-9-16(13)21-17(23)14-10-15(12-20-11-14)18(24)22-19(2,3)4/h6-12H,5H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyNYWVDQHGKBGBOI-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.42
Rot. Bonds4

About 5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide

5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide (PubChem CID 109106923) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
PubChem CID109106923
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1cncc(C(=O)NC(C)(C)C)c1
InChIInChI=1S/C19H23N3O2/c1-5-13-8-6-7-9-16(13)21-17(23)14-10-15(12-20-11-14)18(24)22-19(2,3)4/h6-12H,5H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyNYWVDQHGKBGBOI-UHFFFAOYSA-N
XLogP3.42
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-N-tert-butyl-3-N-(2,6-diethylphenyl)pyridine-3,5-dicarboxamide
CID 109106930
5-N-tert-butyl-3-N-(2-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109106949
5-N-cyclopropyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109101623
3-N-butyl-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109102007
5-N-tert-butyl-3-N-phenylpyridine-3,5-dicarboxamide
CID 109106910
5-N-(3-chloro-2-methylphenyl)-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109108471
2-N-tert-butyl-4-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109089264
N-(2-ethylphenyl)-5-(2-methylpropylamino)pyridine-3-carboxamide
CID 109225020
5-N-(2-ethylphenyl)-3-N-[(2-fluorophenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105539
3-N-(3-chlorophenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109108469
3-N-(4-ethoxyphenyl)-5-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109108480
5-N-(2-ethylphenyl)-3-N-(3-methoxypropyl)pyridine-3,5-dicarboxamide
CID 109103642

Frequently Asked Questions

What is the IUPAC name of 5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide (CID 109106923) is 5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide is CCc1ccccc1NC(=O)c1cncc(C(=O)NC(C)(C)C)c1.
What is the InChIKey of 5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
The InChIKey is NYWVDQHGKBGBOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-5-13-8-6-7-9-16(13)21-17(23)14-10-15(12-20-11-14)18(24)22-19(2,3)4/h6-12H,5H2,1-4H3,(H,21,23)(H,22,24).
What are the key properties of 5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide?
5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide has a molecular weight of 325.41 g/mol, XLogP of 3.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-tert-butyl-3-N-(2-ethylphenyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109106923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).