4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide

C16H18FN3O — CID 81238867

IUPAC4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide
SMILESCCNc1cc(C)ncc1C(=O)Nc1ccc(C)cc1F
InChIInChI=1S/C16H18FN3O/c1-4-18-15-8-11(3)19-9-12(15)16(21)20-14-6-5-10(2)7-13(14)17/h5-9H,4H2,1-3H3,(H,18,19)(H,20,21)
InChIKeyMACCVXQWIIBOHR-UHFFFAOYSA-N
MW287.34 g/mol
LogP3.52
Rot. Bonds4

About 4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide

4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide (PubChem CID 81238867) has the molecular formula C16H18FN3O and a molecular weight of 287.34 g/mol. Its IUPAC name is 4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide
PubChem CID81238867
Molecular FormulaC16H18FN3O
Molecular Weight287.34 g/mol
Exact Mass287.14
IUPAC Name4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide
SMILESCCNc1cc(C)ncc1C(=O)Nc1ccc(C)cc1F
InChIInChI=1S/C16H18FN3O/c1-4-18-15-8-11(3)19-9-12(15)16(21)20-14-6-5-10(2)7-13(14)17/h5-9H,4H2,1-3H3,(H,18,19)(H,20,21)
InChIKeyMACCVXQWIIBOHR-UHFFFAOYSA-N
XLogP3.52
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-3-fluorophenyl)-4-(ethylamino)-6-methylpyridine-3-carboxamide
CID 81234726
2-(ethylamino)-N-(2-fluoro-4-methylphenyl)pyridine-3-carboxamide
CID 62185386
2-(ethylamino)-N-(2-fluorophenyl)-5-methylbenzamide
CID 62511053
N-(2,6-dimethylphenyl)-4-(ethylamino)-6-methylpyridine-3-carboxamide
CID 81237854
4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide
CID 81237833
4-(ethylamino)-6-methyl-N-pyridin-2-ylpyridine-3-carboxamide
CID 81236954
N-(5-chloro-2-pyridinyl)-2-(ethylamino)-5-methylbenzamide
CID 62508806
4-(ethylamino)-6-methyl-N-(3-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 81234677
4-(ethylamino)-6-methyl-N-pyridin-3-ylpyridine-3-carboxamide
CID 81235839
4-(ethylamino)-6-methyl-N-propylpyridine-3-carboxamide
CID 81236373
N-(4-cyanophenyl)-4-(ethylamino)-6-methylpyridine-3-carboxamide
CID 81239209
5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
CID 62166155

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide (CID 81238867) is 4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide is CCNc1cc(C)ncc1C(=O)Nc1ccc(C)cc1F.
What is the InChIKey of 4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide?
The InChIKey is MACCVXQWIIBOHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O/c1-4-18-15-8-11(3)19-9-12(15)16(21)20-14-6-5-10(2)7-13(14)17/h5-9H,4H2,1-3H3,(H,18,19)(H,20,21).
What are the key properties of 4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide?
4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide has a molecular weight of 287.34 g/mol, XLogP of 3.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81238867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).