N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide

C21H26N4O2 — CID 86911597

IUPACN-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide
SMILESCC(=O)N1CCC(NC(=O)CNC(c2ccccc2)c2ccccn2)CC1
InChIInChI=1S/C21H26N4O2/c1-16(26)25-13-10-18(11-14-25)24-20(27)15-23-21(17-7-3-2-4-8-17)19-9-5-6-12-22-19/h2-9,12,18,21,23H,10-11,13-15H2,1H3,(H,24,27)
InChIKeyUJMQCZDBUGXTKF-UHFFFAOYSA-N
MW366.46 g/mol
LogP1.89
Rot. Bonds6

About N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide

N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide (PubChem CID 86911597) has the molecular formula C21H26N4O2 and a molecular weight of 366.46 g/mol. Its IUPAC name is N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide
PubChem CID86911597
Molecular FormulaC21H26N4O2
Molecular Weight366.46 g/mol
Exact Mass366.21
IUPAC NameN-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide
SMILESCC(=O)N1CCC(NC(=O)CNC(c2ccccc2)c2ccccn2)CC1
InChIInChI=1S/C21H26N4O2/c1-16(26)25-13-10-18(11-14-25)24-20(27)15-23-21(17-7-3-2-4-8-17)19-9-5-6-12-22-19/h2-9,12,18,21,23H,10-11,13-15H2,1H3,(H,24,27)
InChIKeyUJMQCZDBUGXTKF-UHFFFAOYSA-N
XLogP1.89
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl (3R)-3-[[(S)-phenyl(pyridin-2-yl)methyl]amino]pyrrolidine-1-carboxylate
CID 99781986
N-[(1R)-1-phenylethyl]-2-[[(R)-phenyl(pyridin-2-yl)methyl]amino]acetamide
CID 32725839
N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide
CID 32725829
1-[4-(1-pyridin-2-ylethylamino)piperidin-1-yl]ethanone
CID 43223671
2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]-N-propylacetamide
CID 34156353
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]ethanone
CID 86908876
phenyl-[(3S)-3-[[[(S)-phenyl(pyridin-2-yl)methyl]amino]methyl]pyrrolidin-1-yl]methanone
CID 100748164
N-[(2-fluorophenyl)methyl]-2-[[(R)-phenyl(pyridin-2-yl)methyl]amino]acetamide
CID 34159063
ethyl 2-[[phenyl(pyridin-2-yl)methyl]amino]acetate
CID 60681847
methyl 3-phenyl-2-[[2-[[phenyl(pyridin-2-yl)methyl]amino]acetyl]amino]propanoate
CID 78825131
N-methyl-N-(1-phenylethyl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide
CID 55410573
N-[phenyl(pyridin-2-yl)methyl]-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide
CID 126475743

Frequently Asked Questions

What is the IUPAC name of N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide?
The IUPAC name of N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide (CID 86911597) is N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide.
What is the SMILES notation for N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide?
The canonical SMILES for N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide is CC(=O)N1CCC(NC(=O)CNC(c2ccccc2)c2ccccn2)CC1.
What is the InChIKey of N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide?
The InChIKey is UJMQCZDBUGXTKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c1-16(26)25-13-10-18(11-14-25)24-20(27)15-23-21(17-7-3-2-4-8-17)19-9-5-6-12-22-19/h2-9,12,18,21,23H,10-11,13-15H2,1H3,(H,24,27).
What are the key properties of N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide?
N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide has a molecular weight of 366.46 g/mol, XLogP of 1.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide is sourced from PubChem (CID 86911597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).