5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide

C18H23N3O2 — CID 109181135

IUPAC5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)NCC(C)C)nc1
InChIInChI=1S/C18H23N3O2/c1-4-23-17-8-6-5-7-15(17)21-14-9-10-16(19-12-14)18(22)20-11-13(2)3/h5-10,12-13,21H,4,11H2,1-3H3,(H,20,22)
InChIKeyPJVCUFJQVUZWJZ-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.61
Rot. Bonds7

About 5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide

5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide (PubChem CID 109181135) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is 5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide
PubChem CID109181135
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC Name5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)NCC(C)C)nc1
InChIInChI=1S/C18H23N3O2/c1-4-23-17-8-6-5-7-15(17)21-14-9-10-16(19-12-14)18(22)20-11-13(2)3/h5-10,12-13,21H,4,11H2,1-3H3,(H,20,22)
InChIKeyPJVCUFJQVUZWJZ-UHFFFAOYSA-N
XLogP3.61
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181136
5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197177
methyl 4-[[5-(2-ethoxyanilino)pyridine-2-carbonyl]amino]benzoate
CID 109200002
5-(2-ethoxyanilino)-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 109189418
6-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-3-carboxamide
CID 109151913
N-(2,6-difluorophenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109200015
N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109198092
N-(3-methylbutyl)-5-(2-propan-2-yloxyanilino)pyridine-2-carboxamide
CID 109195550
5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197592
N-(3-acetylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109199996
5-(4-chloro-2,5-dimethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181187
4-(2-ethoxyanilino)-N-(3-methylbutyl)pyridine-2-carboxamide
CID 109217325

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide?
The IUPAC name of 5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide (CID 109181135) is 5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide is CCOc1ccccc1Nc1ccc(C(=O)NCC(C)C)nc1.
What is the InChIKey of 5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide?
The InChIKey is PJVCUFJQVUZWJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-4-23-17-8-6-5-7-15(17)21-14-9-10-16(19-12-14)18(22)20-11-13(2)3/h5-10,12-13,21H,4,11H2,1-3H3,(H,20,22).
What are the key properties of 5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide?
5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide has a molecular weight of 313.40 g/mol, XLogP of 3.61, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 109181135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).