4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide

C17H27N3O — CID 114428740

IUPAC4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCCN(C)c2ccccc2)C1
InChIInChI=1S/C17H27N3O/c1-3-14-9-10-18-16(13-14)17(21)19-11-12-20(2)15-7-5-4-6-8-15/h4-8,14,16,18H,3,9-13H2,1-2H3,(H,19,21)
InChIKeyHDNOARFEMKQYFW-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.02
Rot. Bonds6

About 4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide

4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide (PubChem CID 114428740) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide
PubChem CID114428740
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NCCN(C)c2ccccc2)C1
InChIInChI=1S/C17H27N3O/c1-3-14-9-10-18-16(13-14)17(21)19-11-12-20(2)15-7-5-4-6-8-15/h4-8,14,16,18H,3,9-13H2,1-2H3,(H,19,21)
InChIKeyHDNOARFEMKQYFW-UHFFFAOYSA-N
XLogP2.02
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-[2-(N-methylanilino)ethyl]pyrrolidine-2-carboxamide
CID 61260470
(2R)-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide
CID 103813393
4-ethyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
CID 114428936
4-ethyl-N-(2-methyl-2-phenylpropyl)piperidine-2-carboxamide
CID 114428574
4-ethyl-N-[2-(4-fluorophenyl)ethyl]piperidine-2-carboxamide
CID 114427828
4-ethyl-N-[2-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide
CID 106260831
N-[2-(N-methylanilino)ethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 119837640
4-ethyl-N-(3-hydroxypropyl)piperidine-2-carboxamide
CID 114428024
N-[2-(N-methylanilino)ethyl]-2-piperidin-4-ylacetamide
CID 61260106
4-ethyl-N-(1-phenylethyl)piperidine-2-carboxamide
CID 114427805
4-ethyl-N-(4-hydroxybutyl)piperidine-2-carboxamide
CID 106841954
7-[(4-ethylpiperidine-2-carbonyl)amino]heptanoic acid
CID 114428646

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide (CID 114428740) is 4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide is CCC1CCNC(C(=O)NCCN(C)c2ccccc2)C1.
What is the InChIKey of 4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide?
The InChIKey is HDNOARFEMKQYFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-3-14-9-10-18-16(13-14)17(21)19-11-12-20(2)15-7-5-4-6-8-15/h4-8,14,16,18H,3,9-13H2,1-2H3,(H,19,21).
What are the key properties of 4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide?
4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide has a molecular weight of 289.42 g/mol, XLogP of 2.02, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-(N-methylanilino)ethyl]piperidine-2-carboxamide is sourced from PubChem (CID 114428740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).