N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide

C21H26N4O2 — CID 109240563

IUPACN-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide
SMILESCCC1CCCCN1C(=O)c1cncc(Nc2cccc(NC(C)=O)c2)c1
InChIInChI=1S/C21H26N4O2/c1-3-20-9-4-5-10-25(20)21(27)16-11-19(14-22-13-16)24-18-8-6-7-17(12-18)23-15(2)26/h6-8,11-14,20,24H,3-5,9-10H2,1-2H3,(H,23,26)
InChIKeyCFTZYGDWAXGDJF-UHFFFAOYSA-N
MW366.47 g/mol
LogP4.19
Rot. Bonds5

About N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide

N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide (PubChem CID 109240563) has the molecular formula C21H26N4O2 and a molecular weight of 366.47 g/mol. Its IUPAC name is N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide
PubChem CID109240563
Molecular FormulaC21H26N4O2
Molecular Weight366.47 g/mol
Exact Mass366.21
IUPAC NameN-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide
SMILESCCC1CCCCN1C(=O)c1cncc(Nc2cccc(NC(C)=O)c2)c1
InChIInChI=1S/C21H26N4O2/c1-3-20-9-4-5-10-25(20)21(27)16-11-19(14-22-13-16)24-18-8-6-7-17(12-18)23-15(2)26/h6-8,11-14,20,24H,3-5,9-10H2,1-2H3,(H,23,26)
InChIKeyCFTZYGDWAXGDJF-UHFFFAOYSA-N
XLogP4.19
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]ethanone
CID 109240561
N-(3-acetamidophenyl)-5-(2-ethylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109107464
(2-ethylpiperidin-1-yl)-[5-(4-propan-2-yloxyanilino)-3-pyridinyl]methanone
CID 109240554
[5-(cyclohexylamino)-3-pyridinyl]-(2-ethylpiperidin-1-yl)methanone
CID 109226885
[5-(2-ethoxyanilino)-3-pyridinyl]-(2-ethylpiperidin-1-yl)methanone
CID 109240550
[5-(butan-2-ylamino)-3-pyridinyl]-(2-ethylpiperidin-1-yl)methanone
CID 109225384
N-(3-acetylphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056486
N-(3-acetamidophenyl)-3-(2-ethylpiperidin-1-yl)-3-oxopropanamide
CID 108952246
azepan-1-yl-[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]methanone
CID 109107415
(2R)-2-ethyl-N-[3-[[(2R)-2-ethylpiperidine-1-carbonyl]amino]phenyl]piperidine-1-carboxamide
CID 7190614
1-[3-[[6-(2-ethylpiperidine-1-carbonyl)pyridazin-3-yl]amino]phenyl]ethanone
CID 109125899
N-(2,3-dimethylphenyl)-5-(2-ethylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109107428

Frequently Asked Questions

What is the IUPAC name of N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide?
The IUPAC name of N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide (CID 109240563) is N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide.
What is the SMILES notation for N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide?
The canonical SMILES for N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide is CCC1CCCCN1C(=O)c1cncc(Nc2cccc(NC(C)=O)c2)c1.
What is the InChIKey of N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide?
The InChIKey is CFTZYGDWAXGDJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c1-3-20-9-4-5-10-25(20)21(27)16-11-19(14-22-13-16)24-18-8-6-7-17(12-18)23-15(2)26/h6-8,11-14,20,24H,3-5,9-10H2,1-2H3,(H,23,26).
What are the key properties of N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide?
N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide has a molecular weight of 366.47 g/mol, XLogP of 4.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[5-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]acetamide is sourced from PubChem (CID 109240563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).