2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide

C20H18N4O2 — CID 177434462

IUPAC2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide
SMILESO=C(Cc1ccc(CC(=O)Nc2cccnc2)cc1)Nc1cccnc1
InChIInChI=1S/C20H18N4O2/c25-19(23-17-3-1-9-21-13-17)11-15-5-7-16(8-6-15)12-20(26)24-18-4-2-10-22-14-18/h1-10,13-14H,11-12H2,(H,23,25)(H,24,26)
InChIKeyMGNFSQXAAMPTTF-UHFFFAOYSA-N
MW346.39 g/mol
LogP2.84
Rot. Bonds6

About 2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide

2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide (PubChem CID 177434462) has the molecular formula C20H18N4O2 and a molecular weight of 346.39 g/mol. Its IUPAC name is 2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide
PubChem CID177434462
Molecular FormulaC20H18N4O2
Molecular Weight346.39 g/mol
Exact Mass346.14
IUPAC Name2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide
SMILESO=C(Cc1ccc(CC(=O)Nc2cccnc2)cc1)Nc1cccnc1
InChIInChI=1S/C20H18N4O2/c25-19(23-17-3-1-9-21-13-17)11-15-5-7-16(8-6-15)12-20(26)24-18-4-2-10-22-14-18/h1-10,13-14H,11-12H2,(H,23,25)(H,24,26)
InChIKeyMGNFSQXAAMPTTF-UHFFFAOYSA-N
XLogP2.84
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methylphenyl)-N-pyridin-3-ylacetamide
CID 890802
2-[4-(N'-hydroxycarbamimidoyl)phenyl]-N-pyridin-3-ylacetamide
CID 77001775
2-(2-fluorophenyl)-N-pyridin-3-ylacetamide
CID 4195275
2-(2,4-difluorophenyl)-N-pyridin-3-ylacetamide
CID 110488862
2-cyclopropyl-N-pyridin-3-ylacetamide
CID 131129634
3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide
CID 129281433
N-cyclopropyl-2-[4-[(2-pyridin-3-ylacetyl)amino]phenyl]acetamide
CID 131905029
5-(4-bromophenyl)-N-pyridin-3-ylpentanamide
CID 166191110
[5-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]carbamic acid
CID 90107603
4-[2-oxo-2-(pyridin-3-ylamino)ethyl]-1,3-thiazole-5-carboxylic acid
CID 70919678
2-[(2-methylpropan-2-yl)oxy]-N-pyridin-3-ylacetamide
CID 112604829
1,3-bis[[4-(pyridin-3-ylcarbamoylamino)phenyl]methyl]urea
CID 135869753

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide?
The IUPAC name of 2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide (CID 177434462) is 2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide is O=C(Cc1ccc(CC(=O)Nc2cccnc2)cc1)Nc1cccnc1.
What is the InChIKey of 2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide?
The InChIKey is MGNFSQXAAMPTTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O2/c25-19(23-17-3-1-9-21-13-17)11-15-5-7-16(8-6-15)12-20(26)24-18-4-2-10-22-14-18/h1-10,13-14H,11-12H2,(H,23,25)(H,24,26).
What are the key properties of 2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide?
2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide has a molecular weight of 346.39 g/mol, XLogP of 2.84, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide is sourced from PubChem (CID 177434462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).