N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide

C18H23N3O — CID 109216854

IUPACN-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide
SMILESCCN(c1ccccc1)c1ccnc(C(=O)NC(C)(C)C)c1
InChIInChI=1S/C18H23N3O/c1-5-21(14-9-7-6-8-10-14)15-11-12-19-16(13-15)17(22)20-18(2,3)4/h6-13H,5H2,1-4H3,(H,20,22)
InChIKeyFGYPEPGRIKMEFV-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.77
Rot. Bonds4

About N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide

N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide (PubChem CID 109216854) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide
PubChem CID109216854
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC NameN-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide
SMILESCCN(c1ccccc1)c1ccnc(C(=O)NC(C)(C)C)c1
InChIInChI=1S/C18H23N3O/c1-5-21(14-9-7-6-8-10-14)15-11-12-19-16(13-15)17(22)20-18(2,3)4/h6-13H,5H2,1-4H3,(H,20,22)
InChIKeyFGYPEPGRIKMEFV-UHFFFAOYSA-N
XLogP3.77
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(N-ethylanilino)-N-(1-phenylethyl)pyridine-2-carboxamide
CID 109210693
N-(4-acetamidophenyl)-4-(N-ethylanilino)pyridine-2-carboxamide
CID 109220336
2-N-tert-butyl-4-N-ethyl-4-N-phenylpyridine-2,4-dicarboxamide
CID 109089266
4-(N-ethylanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109219349
4-(N-ethylanilino)-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 109211188
N-[(2-chlorophenyl)methyl]-4-(N-ethylanilino)pyridine-2-carboxamide
CID 109211655
4-(N-ethylanilino)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109220319
4-(N-ethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 109220359
N-(3-chloro-4-fluorophenyl)-4-(N-ethylanilino)pyridine-2-carboxamide
CID 109220315
N-tert-butyl-5-(N-ethyl-3-methylanilino)pyridine-2-carboxamide
CID 109195162
N-tert-butyl-4-[carbamoyl(2-phenylethyl)amino]pyridine-2-carboxamide
CID 155286011
N-benzyl-4-(N-ethyl-3-methylanilino)pyridine-2-carboxamide
CID 109209759

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide?
The IUPAC name of N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide (CID 109216854) is N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide is CCN(c1ccccc1)c1ccnc(C(=O)NC(C)(C)C)c1.
What is the InChIKey of N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide?
The InChIKey is FGYPEPGRIKMEFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O/c1-5-21(14-9-7-6-8-10-14)15-11-12-19-16(13-15)17(22)20-18(2,3)4/h6-13H,5H2,1-4H3,(H,20,22).
What are the key properties of N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide?
N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide has a molecular weight of 297.40 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-4-(N-ethylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109216854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).