5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide

C19H23N3O2 — CID 109102383

IUPAC5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide
SMILESCCc1ccc(NC(=O)c2cncc(C(=O)NC(C)CC)c2)cc1
InChIInChI=1S/C19H23N3O2/c1-4-13(3)21-18(23)15-10-16(12-20-11-15)19(24)22-17-8-6-14(5-2)7-9-17/h6-13H,4-5H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyOXFSIAUWZQTTLP-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.42
Rot. Bonds6

About 5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide

5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide (PubChem CID 109102383) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide
PubChem CID109102383
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide
SMILESCCc1ccc(NC(=O)c2cncc(C(=O)NC(C)CC)c2)cc1
InChIInChI=1S/C19H23N3O2/c1-4-13(3)21-18(23)15-10-16(12-20-11-15)19(24)22-17-8-6-14(5-2)7-9-17/h6-13H,4-5H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyOXFSIAUWZQTTLP-UHFFFAOYSA-N
XLogP3.42
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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

3-N-butan-2-yl-1-N-(4-ethylphenyl)benzene-1,3-dicarboxamide
CID 109051525
5-N-butan-2-yl-3-N-(4-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide
CID 109102415
3-N-(4-ethylphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide
CID 109105379
5-N-(4-ethylphenyl)-3-N-(4-methylphenyl)pyridine-3,5-dicarboxamide
CID 109107992
3-N-(3-acetylphenyl)-5-N-butan-2-ylpyridine-3,5-dicarboxamide
CID 109102422
N-(4-ethylphenyl)-5-hydroxypyridine-3-carboxamide
CID 55258455
3-N-[2-(dimethylamino)ethyl]-5-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide
CID 109104100
N-(4-ethylphenyl)-5-(1-phenylethylamino)pyridine-3-carboxamide
CID 109232942
5-(butan-2-ylamino)-N-(4-methylphenyl)pyridine-3-carboxamide
CID 109225394
5-(4-ethylanilino)-N-(4-methylphenyl)pyridine-3-carboxamide
CID 109242019
methyl 4-[[4-(butan-2-ylcarbamoyl)phenyl]carbamoyl]benzoate
CID 17201378
N-butan-2-yl-5-fluoropyridine-3-carboxamide
CID 115694418

Frequently Asked Questions

What is the IUPAC name of 5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide (CID 109102383) is 5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide is CCc1ccc(NC(=O)c2cncc(C(=O)NC(C)CC)c2)cc1.
What is the InChIKey of 5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide?
The InChIKey is OXFSIAUWZQTTLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-4-13(3)21-18(23)15-10-16(12-20-11-15)19(24)22-17-8-6-14(5-2)7-9-17/h6-13H,4-5H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of 5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide?
5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide has a molecular weight of 325.41 g/mol, XLogP of 3.42, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-butan-2-yl-3-N-(4-ethylphenyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109102383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).