2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide

C18H23N3O2 — CID 109174723

IUPAC2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide
SMILESCCOc1ccccc1Nc1cc(C(=O)N(CC)CC)ccn1
InChIInChI=1S/C18H23N3O2/c1-4-21(5-2)18(22)14-11-12-19-17(13-14)20-15-9-7-8-10-16(15)23-6-3/h7-13H,4-6H2,1-3H3,(H,19,20)
InChIKeyDKQMXBNUSLMHSQ-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.71
Rot. Bonds7

About 2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide

2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide (PubChem CID 109174723) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide
PubChem CID109174723
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC Name2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide
SMILESCCOc1ccccc1Nc1cc(C(=O)N(CC)CC)ccn1
InChIInChI=1S/C18H23N3O2/c1-4-21(5-2)18(22)14-11-12-19-17(13-14)20-15-9-7-8-10-16(15)23-6-3/h7-13H,4-6H2,1-3H3,(H,19,20)
InChIKeyDKQMXBNUSLMHSQ-UHFFFAOYSA-N
XLogP3.71
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethoxyanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 109172626
6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
CID 109124452
5-(2-ethoxyanilino)-N,N-diethylpyrazine-2-carboxamide
CID 109286788
N-[(4-chlorophenyl)methyl]-2-(2-ethoxyanilino)pyridine-4-carboxamide
CID 109170899
N-(2-ethoxyphenyl)-2-(2-fluoroanilino)pyridine-4-carboxamide
CID 109177245
2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide
CID 109174721
N-benzyl-2-(2,4-dimethoxyanilino)-N-ethylpyridine-4-carboxamide
CID 109171538
2-(2-bromoanilino)-N,N-dipropylpyridine-4-carboxamide
CID 109175871
2-(2-cyanoanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide
CID 109178127
N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide
CID 62172696
2-(2-ethoxyanilino)pyridine-4-carbonitrile
CID 24704594
2-(4-acetylanilino)-N-(2-ethoxyphenyl)pyridine-4-carboxamide
CID 109178114

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide?
The IUPAC name of 2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide (CID 109174723) is 2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide.
What is the SMILES notation for 2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide?
The canonical SMILES for 2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide is CCOc1ccccc1Nc1cc(C(=O)N(CC)CC)ccn1.
What is the InChIKey of 2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide?
The InChIKey is DKQMXBNUSLMHSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-4-21(5-2)18(22)14-11-12-19-17(13-14)20-15-9-7-8-10-16(15)23-6-3/h7-13H,4-6H2,1-3H3,(H,19,20).
What are the key properties of 2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide?
2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide has a molecular weight of 313.40 g/mol, XLogP of 3.71, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide is sourced from PubChem (CID 109174723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).