2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide

C19H25N3O — CID 113017550

IUPAC2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide
SMILESCCC(CC)C(=O)Nc1ccc(N(CC)c2ccccc2)nc1
InChIInChI=1S/C19H25N3O/c1-4-15(5-2)19(23)21-16-12-13-18(20-14-16)22(6-3)17-10-8-7-9-11-17/h7-15H,4-6H2,1-3H3,(H,21,23)
InChIKeyLUTFRSRGEPDQGW-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.61
Rot. Bonds7

About 2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide

2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide (PubChem CID 113017550) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide
PubChem CID113017550
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide
SMILESCCC(CC)C(=O)Nc1ccc(N(CC)c2ccccc2)nc1
InChIInChI=1S/C19H25N3O/c1-4-15(5-2)19(23)21-16-12-13-18(20-14-16)22(6-3)17-10-8-7-9-11-17/h7-15H,4-6H2,1-3H3,(H,21,23)
InChIKeyLUTFRSRGEPDQGW-UHFFFAOYSA-N
XLogP4.61
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(N-ethylanilino)-3-pyridinyl]-3,4-difluorobenzamide
CID 113017591
N-[6-(N-ethylanilino)-3-pyridinyl]propane-1-sulfonamide
CID 113017610
2-ethyl-N-[6-(methylamino)-3-pyridinyl]butanamide
CID 115268467
N-[6-[4-(dimethylamino)anilino]-3-pyridinyl]-2-ethylbutanamide
CID 113020858
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-methylpropanamide
CID 113012566
2-ethyl-N-[6-(pyridin-2-ylmethylamino)-3-pyridinyl]butanamide
CID 113012657
3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide
CID 62876785
(2S)-2-amino-N-[6-(diethylamino)-3-pyridinyl]-3-phenylpropanamide;dihydrochloride
CID 119845900
N-[6-(2-tert-butylanilino)-3-pyridinyl]-2-ethylbutanamide
CID 113018058
N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide
CID 113022991
2-ethyl-N-[6-(propylamino)-3-pyridinyl]butanamide
CID 113009034
N-[6-(N-propanoylanilino)-3-pyridinyl]propanamide
CID 110175696

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide?
The IUPAC name of 2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide (CID 113017550) is 2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide?
The canonical SMILES for 2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide is CCC(CC)C(=O)Nc1ccc(N(CC)c2ccccc2)nc1.
What is the InChIKey of 2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide?
The InChIKey is LUTFRSRGEPDQGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-4-15(5-2)19(23)21-16-12-13-18(20-14-16)22(6-3)17-10-8-7-9-11-17/h7-15H,4-6H2,1-3H3,(H,21,23).
What are the key properties of 2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide?
2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide has a molecular weight of 311.43 g/mol, XLogP of 4.61, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[6-(N-ethylanilino)-3-pyridinyl]butanamide is sourced from PubChem (CID 113017550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).