N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide

C18H28N2O — CID 106778270

IUPACN-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide
SMILESCCNC(=O)C1CC(Cc2c(C)cc(C)cc2C)CCN1
InChIInChI=1S/C18H28N2O/c1-5-19-18(21)17-11-15(6-7-20-17)10-16-13(3)8-12(2)9-14(16)4/h8-9,15,17,20H,5-7,10-11H2,1-4H3,(H,19,21)
InChIKeyLGORRFJDSGUQIJ-UHFFFAOYSA-N
MW288.44 g/mol
LogP2.66
Rot. Bonds4

About N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide

N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide (PubChem CID 106778270) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide
PubChem CID106778270
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide
SMILESCCNC(=O)C1CC(Cc2c(C)cc(C)cc2C)CCN1
InChIInChI=1S/C18H28N2O/c1-5-19-18(21)17-11-15(6-7-20-17)10-16-13(3)8-12(2)9-14(16)4/h8-9,15,17,20H,5-7,10-11H2,1-4H3,(H,19,21)
InChIKeyLGORRFJDSGUQIJ-UHFFFAOYSA-N
XLogP2.66
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(3,5-dimethylphenyl)methyl]-N-ethylpiperidine-2-carboxamide
CID 106777885
4-[(3,5-difluorophenyl)methyl]-N-ethylpiperidine-2-carboxamide
CID 106781871
N-ethyl-4-[(5-fluoro-2-methylphenyl)methyl]piperidine-2-carboxamide
CID 106781844
4-(2-cyclopropylethyl)-N-ethylpiperidine-2-carboxamide
CID 106779884
N-ethyl-4-[(2-fluorophenyl)methyl]piperidine-2-carboxamide
CID 106777776
4-ethyl-N-[2-(ethylamino)-2-oxoethyl]piperidine-2-carboxamide
CID 114428095
4-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-2-carboxamide
CID 114428064
4-ethyl-N-[(5-methylpyrazin-2-yl)methyl]piperidine-2-carboxamide
CID 114428953
4-ethyl-N-[(4-hydroxyphenyl)methyl]piperidine-2-carboxamide
CID 114429606
N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110793633
4-ethyl-N-(4-fluoro-3-methylphenyl)piperidine-2-carboxamide
CID 114428947
4-ethyl-N-[2-(4-fluorophenyl)ethyl]piperidine-2-carboxamide
CID 114427828

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide?
The IUPAC name of N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide (CID 106778270) is N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide.
What is the SMILES notation for N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide?
The canonical SMILES for N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide is CCNC(=O)C1CC(Cc2c(C)cc(C)cc2C)CCN1.
What is the InChIKey of N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide?
The InChIKey is LGORRFJDSGUQIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-5-19-18(21)17-11-15(6-7-20-17)10-16-13(3)8-12(2)9-14(16)4/h8-9,15,17,20H,5-7,10-11H2,1-4H3,(H,19,21).
What are the key properties of N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide?
N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide has a molecular weight of 288.44 g/mol, XLogP of 2.66, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[(2,4,6-trimethylphenyl)methyl]piperidine-2-carboxamide is sourced from PubChem (CID 106778270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).