N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide

C19H28N2O2 — CID 113161630

IUPACN-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide
SMILESCCC1CCCCN1C(=O)CN(Cc1cccc(C)c1)C(C)=O
InChIInChI=1S/C19H28N2O2/c1-4-18-10-5-6-11-21(18)19(23)14-20(16(3)22)13-17-9-7-8-15(2)12-17/h7-9,12,18H,4-6,10-11,13-14H2,1-3H3
InChIKeyUQTOROWKOXSPDZ-UHFFFAOYSA-N
MW316.44 g/mol
LogP3.13
Rot. Bonds5

About N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide

N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide (PubChem CID 113161630) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide.

Molecular Properties

Compound NameN-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide
PubChem CID113161630
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC NameN-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide
SMILESCCC1CCCCN1C(=O)CN(Cc1cccc(C)c1)C(C)=O
InChIInChI=1S/C19H28N2O2/c1-4-18-10-5-6-11-21(18)19(23)14-20(16(3)22)13-17-9-7-8-15(2)12-17/h7-9,12,18H,4-6,10-11,13-14H2,1-3H3
InChIKeyUQTOROWKOXSPDZ-UHFFFAOYSA-N
XLogP3.13
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-(3-phenylpropyl)acetamide
CID 113165843
N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-(furan-2-ylmethyl)acetamide
CID 113161044
N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 113164380
N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-(4-methylphenyl)acetamide
CID 113167733
N-(3,5-dimethylphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide
CID 113168511
N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 113164856
N-benzyl-N-ethyl-3-(2-ethylpiperidin-1-yl)-3-oxopropanamide
CID 108947324
N-ethyl-3-(2-ethylpiperidin-1-yl)-N-(3-methylphenyl)-3-oxopropanamide
CID 108952293
1-[2-(aminomethyl)azepan-1-yl]-2-(3-methylphenyl)ethanone
CID 116639946
N-[3-(azepan-1-yl)-3-oxopropyl]-N-[(3-methylphenyl)methyl]acetamide
CID 113118624
1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone
CID 61399838
1-[2-(aminomethyl)piperidin-1-yl]-3-(3-methylphenyl)propan-1-one
CID 62366943

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide?
The IUPAC name of N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide (CID 113161630) is N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide.
What is the SMILES notation for N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide?
The canonical SMILES for N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide is CCC1CCCCN1C(=O)CN(Cc1cccc(C)c1)C(C)=O.
What is the InChIKey of N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide?
The InChIKey is UQTOROWKOXSPDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-4-18-10-5-6-11-21(18)19(23)14-20(16(3)22)13-17-9-7-8-15(2)12-17/h7-9,12,18H,4-6,10-11,13-14H2,1-3H3.
What are the key properties of N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide?
N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide has a molecular weight of 316.44 g/mol, XLogP of 3.13, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-N-[(3-methylphenyl)methyl]acetamide is sourced from PubChem (CID 113161630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).