4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide

C17H26N2O2 — CID 104921952

IUPAC4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)N[C@@H](C)c2ccccc2OC)C1
InChIInChI=1S/C17H26N2O2/c1-4-13-9-10-18-15(11-13)17(20)19-12(2)14-7-5-6-8-16(14)21-3/h5-8,12-13,15,18H,4,9-11H2,1-3H3,(H,19,20)/t12-,13?,15?/m0/s1
InChIKeyMLCWUOYUXQMPQY-OPFPJEHXSA-N
MW290.41 g/mol
LogP2.65
Rot. Bonds5

About 4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide

4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide (PubChem CID 104921952) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide
PubChem CID104921952
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)N[C@@H](C)c2ccccc2OC)C1
InChIInChI=1S/C17H26N2O2/c1-4-13-9-10-18-15(11-13)17(20)19-12(2)14-7-5-6-8-16(14)21-3/h5-8,12-13,15,18H,4,9-11H2,1-3H3,(H,19,20)/t12-,13?,15?/m0/s1
InChIKeyMLCWUOYUXQMPQY-OPFPJEHXSA-N
XLogP2.65
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-(1-phenylethyl)piperidine-2-carboxamide
CID 114427805
(2S)-N-[(1R)-1-(2-methoxyphenyl)ethyl]pyrrolidine-2-carboxamide
CID 81387712
4-ethyl-N-(2-methoxyphenyl)piperidine-2-carboxamide
CID 114427816
(2S)-N-[1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide;hydrochloride
CID 119683030
4-ethyl-N-[2-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide
CID 106260831
4-ethyl-N-[(1S)-1-(3-methylphenyl)ethyl]piperidine-2-carboxamide
CID 104921936
N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-4-ethylpiperidine-2-carboxamide
CID 114428161
4-ethyl-N-(3-methylbutan-2-yl)piperidine-2-carboxamide
CID 114428012
4-ethyl-N-(1-methoxypropan-2-yl)piperidine-2-carboxamide
CID 114427831
N-[1-(5-chlorothiophen-2-yl)ethyl]-4-ethylpiperidine-2-carboxamide
CID 114428229
4-ethyl-N-(1-hydroxybutan-2-yl)piperidine-2-carboxamide
CID 114428056
N-[1-(2-chlorophenyl)propan-2-yl]-4-ethylpiperidine-2-carboxamide
CID 114428187

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide?
The IUPAC name of 4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide (CID 104921952) is 4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide is CCC1CCNC(C(=O)N[C@@H](C)c2ccccc2OC)C1.
What is the InChIKey of 4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide?
The InChIKey is MLCWUOYUXQMPQY-OPFPJEHXSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-4-13-9-10-18-15(11-13)17(20)19-12(2)14-7-5-6-8-16(14)21-3/h5-8,12-13,15,18H,4,9-11H2,1-3H3,(H,19,20)/t12-,13?,15?/m0/s1.
What are the key properties of 4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide?
4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[(1S)-1-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide is sourced from PubChem (CID 104921952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).