N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide

C18H26N2O2 — CID 113169094

IUPACN-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide
SMILESCCc1ccccc1N(CC(=O)N1CCCC(C)C1)C(C)=O
InChIInChI=1S/C18H26N2O2/c1-4-16-9-5-6-10-17(16)20(15(3)21)13-18(22)19-11-7-8-14(2)12-19/h5-6,9-10,14H,4,7-8,11-13H2,1-3H3
InChIKeyFGPHMEBNLLIJTJ-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.86
Rot. Bonds4

About N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide

N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide (PubChem CID 113169094) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide
PubChem CID113169094
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC NameN-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide
SMILESCCc1ccccc1N(CC(=O)N1CCCC(C)C1)C(C)=O
InChIInChI=1S/C18H26N2O2/c1-4-16-9-5-6-10-17(16)20(15(3)21)13-18(22)19-11-7-8-14(2)12-19/h5-6,9-10,14H,4,7-8,11-13H2,1-3H3
InChIKeyFGPHMEBNLLIJTJ-UHFFFAOYSA-N
XLogP2.86
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-N-(2-propan-2-ylphenyl)acetamide
CID 113169650
N-[2-(azepan-1-yl)-2-oxoethyl]-N-(2-ethylphenyl)acetamide
CID 113169098
N-(4-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide
CID 113169288
N-(2-fluorophenyl)-N-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]acetamide
CID 113126709
N-[(2-methoxyphenyl)methyl]-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide
CID 113162924
N-(3-methoxyphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide
CID 113173376
N-(4-bromo-3-methylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide
CID 113178178
N-[4-(4-methylpiperazin-1-yl)phenyl]-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide
CID 113177407
1-[(3S)-3-methylpiperidin-1-yl]-2-phenylethanone
CID 668860
N-[2-(azepan-1-yl)-2-oxoethyl]-N-(2-chlorophenyl)acetamide
CID 113171182
2-(N-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl]anilino)acetic acid
CID 51674289
N-[2-(azepan-1-yl)-2-oxoethyl]-N-(2-fluorophenyl)acetamide
CID 113170791

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide?
The IUPAC name of N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide (CID 113169094) is N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide.
What is the SMILES notation for N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide?
The canonical SMILES for N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide is CCc1ccccc1N(CC(=O)N1CCCC(C)C1)C(C)=O.
What is the InChIKey of N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide?
The InChIKey is FGPHMEBNLLIJTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-4-16-9-5-6-10-17(16)20(15(3)21)13-18(22)19-11-7-8-14(2)12-19/h5-6,9-10,14H,4,7-8,11-13H2,1-3H3.
What are the key properties of N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide?
N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide has a molecular weight of 302.42 g/mol, XLogP of 2.86, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide is sourced from PubChem (CID 113169094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).