N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide

C19H30N2O2 — CID 50973228

IUPACN-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide
SMILESCCOc1ccccc1CN(CC)C(=O)CC1CCCCN1C
InChIInChI=1S/C19H30N2O2/c1-4-21(15-16-10-6-7-12-18(16)23-5-2)19(22)14-17-11-8-9-13-20(17)3/h6-7,10,12,17H,4-5,8-9,11,13-15H2,1-3H3
InChIKeyPVLQJNGSPNIYOV-UHFFFAOYSA-N
MW318.46 g/mol
LogP3.31
Rot. Bonds7

About N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide

N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide (PubChem CID 50973228) has the molecular formula C19H30N2O2 and a molecular weight of 318.46 g/mol. Its IUPAC name is N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide.

Molecular Properties

Compound NameN-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide
PubChem CID50973228
Molecular FormulaC19H30N2O2
Molecular Weight318.46 g/mol
Exact Mass318.23
IUPAC NameN-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide
SMILESCCOc1ccccc1CN(CC)C(=O)CC1CCCCN1C
InChIInChI=1S/C19H30N2O2/c1-4-21(15-16-10-6-7-12-18(16)23-5-2)19(22)14-17-11-8-9-13-20(17)3/h6-7,10,12,17H,4-5,8-9,11,13-15H2,1-3H3
InChIKeyPVLQJNGSPNIYOV-UHFFFAOYSA-N
XLogP3.31
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-N-[(2-ethoxyphenyl)methyl]-3-N-ethylpiperidine-1,3-dicarboxamide
CID 95141758
(3S)-3-N-[(2-ethoxyphenyl)methyl]-3-N-ethylpiperidine-1,3-dicarboxamide
CID 95141759
N-[[2-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]methyl]ethanamine
CID 107911038
(2-ethoxyphenyl)-[4-[[(2R)-1-methylpiperidin-2-yl]methyl]piperazin-1-yl]methanone
CID 95304741
N-[(2-chlorophenyl)methyl]-2-cyclopentyl-N-ethylacetamide
CID 78852823
3-(2-ethoxyphenyl)-1-[2-(hydroxymethyl)piperidin-1-yl]propan-1-one
CID 43421333
N-(2-ethylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110857732
2-(2-ethoxyphenyl)-1-[(2R)-2-methylpiperidin-1-yl]ethanone
CID 134503396
N-[(2-ethoxyphenyl)methyl]-2-methylpiperidine-1-carboxamide
CID 47376286
[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate
CID 11011729
2-[(2R)-1-methylpiperidin-2-yl]-N-[(5-methylthiophen-2-yl)methyl]-N-(pyridin-2-ylmethyl)acetamide
CID 99943673
3-[(2-ethoxyphenyl)methylamino]-N,N-diethylpropanamide
CID 60925933

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide?
The IUPAC name of N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide (CID 50973228) is N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide.
What is the SMILES notation for N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide?
The canonical SMILES for N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide is CCOc1ccccc1CN(CC)C(=O)CC1CCCCN1C.
What is the InChIKey of N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide?
The InChIKey is PVLQJNGSPNIYOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2/c1-4-21(15-16-10-6-7-12-18(16)23-5-2)19(22)14-17-11-8-9-13-20(17)3/h6-7,10,12,17H,4-5,8-9,11,13-15H2,1-3H3.
What are the key properties of N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide?
N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide has a molecular weight of 318.46 g/mol, XLogP of 3.31, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethoxyphenyl)methyl]-N-ethyl-2-(1-methylpiperidin-2-yl)acetamide is sourced from PubChem (CID 50973228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).