2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide

C22H24N4O2 — CID 142792292

IUPAC2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide
SMILESNC(=O)C(CCc1ccncc1)(NCCc1ccncc1)c1cccc(O)c1
InChIInChI=1S/C22H24N4O2/c23-21(28)22(19-2-1-3-20(27)16-19,10-4-17-5-11-24-12-6-17)26-15-9-18-7-13-25-14-8-18/h1-3,5-8,11-14,16,26-27H,4,9-10,15H2,(H2,23,28)
InChIKeyXYUKECIHEIVBNT-UHFFFAOYSA-N
MW376.46 g/mol
LogP2.33
Rot. Bonds9

About 2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide

2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide (PubChem CID 142792292) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide.

Molecular Properties

Compound Name2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide
PubChem CID142792292
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide
SMILESNC(=O)C(CCc1ccncc1)(NCCc1ccncc1)c1cccc(O)c1
InChIInChI=1S/C22H24N4O2/c23-21(28)22(19-2-1-3-20(27)16-19,10-4-17-5-11-24-12-6-17)26-15-9-18-7-13-25-14-8-18/h1-3,5-8,11-14,16,26-27H,4,9-10,15H2,(H2,23,28)
InChIKeyXYUKECIHEIVBNT-UHFFFAOYSA-N
XLogP2.33
TPSA101.13 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-naphthalen-2-yl-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide
CID 142792470
2-(4-chlorophenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide
CID 142792052
2-(2,6-dichlorophenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide
CID 142791944
2-(3-methylphenyl)-2-(2-piperidin-4-ylethylamino)-4-pyridin-4-ylbutanamide
CID 142792657
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyridin-4-yl-2-(2-pyridin-3-ylethylamino)butanamide
CID 142791981
2-(2,6-dichlorophenyl)-4-pyridin-4-yl-2-(2-pyridin-3-ylethylamino)butanamide
CID 142792028
2-(4-propan-2-ylphenyl)-4-pyridin-4-yl-2-(2-pyridin-3-ylethylamino)butanamide
CID 142792578
2-(4-propan-2-ylphenyl)-4-pyridin-3-yl-2-(2-pyridin-4-ylethylamino)butanamide
CID 142791845
2-(2-piperidin-4-ylethylamino)-2,4-dipyridin-4-ylbutanamide
CID 142792012
2-(2,3-dichlorophenyl)-4-pyridin-3-yl-2-(2-pyridin-4-ylethylamino)butanamide
CID 142791977
2-(2,3-dimethylphenyl)-4-pyridin-3-yl-2-(2-pyridin-4-ylethylamino)butanamide
CID 142792570
2-(3-methylphenyl)-3-pyridin-4-yl-2-(pyridin-4-ylmethylamino)propanamide
CID 142792098

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide?
The IUPAC name of 2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide (CID 142792292) is 2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide.
What is the SMILES notation for 2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide?
The canonical SMILES for 2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide is NC(=O)C(CCc1ccncc1)(NCCc1ccncc1)c1cccc(O)c1.
What is the InChIKey of 2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide?
The InChIKey is XYUKECIHEIVBNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c23-21(28)22(19-2-1-3-20(27)16-19,10-4-17-5-11-24-12-6-17)26-15-9-18-7-13-25-14-8-18/h1-3,5-8,11-14,16,26-27H,4,9-10,15H2,(H2,23,28).
What are the key properties of 2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide?
2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide has a molecular weight of 376.46 g/mol, XLogP of 2.33, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyphenyl)-4-pyridin-4-yl-2-(2-pyridin-4-ylethylamino)butanamide is sourced from PubChem (CID 142792292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).