2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide

C20H27N3O — CID 109174721

IUPAC2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide
SMILESCCc1cccc(CC)c1Nc1cc(C(=O)N(CC)CC)ccn1
InChIInChI=1S/C20H27N3O/c1-5-15-10-9-11-16(6-2)19(15)22-18-14-17(12-13-21-18)20(24)23(7-3)8-4/h9-14H,5-8H2,1-4H3,(H,21,22)
InChIKeyHPXAZGALFIOVHW-UHFFFAOYSA-N
MW325.46 g/mol
LogP4.43
Rot. Bonds7

About 2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide

2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide (PubChem CID 109174721) has the molecular formula C20H27N3O and a molecular weight of 325.46 g/mol. Its IUPAC name is 2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide
PubChem CID109174721
Molecular FormulaC20H27N3O
Molecular Weight325.46 g/mol
Exact Mass325.22
IUPAC Name2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide
SMILESCCc1cccc(CC)c1Nc1cc(C(=O)N(CC)CC)ccn1
InChIInChI=1S/C20H27N3O/c1-5-15-10-9-11-16(6-2)19(15)22-18-14-17(12-13-21-18)20(24)23(7-3)8-4/h9-14H,5-8H2,1-4H3,(H,21,22)
InChIKeyHPXAZGALFIOVHW-UHFFFAOYSA-N
XLogP4.43
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide
CID 62172696
2-(2,6-diethylanilino)-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide
CID 109171655
2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide
CID 109174723
2-(2-ethyl-6-methylanilino)-N-(2-methoxyethyl)pyridine-4-carboxamide
CID 109166794
N-ethyl-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-carboxamide
CID 55042857
N-ethyl-2-(ethylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 62181870
3-N-(2,6-diethylphenyl)-5-N,5-N-diethylpyridine-3,5-dicarboxamide
CID 109106761
2-(2-bromoanilino)-N,N-dipropylpyridine-4-carboxamide
CID 109175871
N-benzyl-2-(3,4-difluoroanilino)-N-ethylpyridine-4-carboxamide
CID 109171558
N-benzyl-N-ethyl-2-(propylamino)pyridine-4-carboxamide
CID 109165092
N-benzyl-2-(2,6-diethylanilino)-N-ethylpyrimidine-5-carboxamide
CID 109258372
N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide
CID 79470982

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide?
The IUPAC name of 2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide (CID 109174721) is 2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide.
What is the SMILES notation for 2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide?
The canonical SMILES for 2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide is CCc1cccc(CC)c1Nc1cc(C(=O)N(CC)CC)ccn1.
What is the InChIKey of 2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide?
The InChIKey is HPXAZGALFIOVHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O/c1-5-15-10-9-11-16(6-2)19(15)22-18-14-17(12-13-21-18)20(24)23(7-3)8-4/h9-14H,5-8H2,1-4H3,(H,21,22).
What are the key properties of 2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide?
2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide has a molecular weight of 325.46 g/mol, XLogP of 4.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-diethylanilino)-N,N-diethylpyridine-4-carboxamide is sourced from PubChem (CID 109174721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).