N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide

C16H24N2O2 — CID 106261488

IUPACN-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide
SMILESCOc1ccccc1CCNC(=O)C1CNCC(C)C1
InChIInChI=1S/C16H24N2O2/c1-12-9-14(11-17-10-12)16(19)18-8-7-13-5-3-4-6-15(13)20-2/h3-6,12,14,17H,7-11H2,1-2H3,(H,18,19)
InChIKeyZZGDDYXBTSYKCQ-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.60
Rot. Bonds5

About N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide

N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide (PubChem CID 106261488) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide
PubChem CID106261488
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide
SMILESCOc1ccccc1CCNC(=O)C1CNCC(C)C1
InChIInChI=1S/C16H24N2O2/c1-12-9-14(11-17-10-12)16(19)18-8-7-13-5-3-4-6-15(13)20-2/h3-6,12,14,17H,7-11H2,1-2H3,(H,18,19)
InChIKeyZZGDDYXBTSYKCQ-UHFFFAOYSA-N
XLogP1.60
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-methoxyphenyl)ethyl]azetidine-3-carboxamide
CID 113411784
cis-(1R,2S)-2-[2-(2-methoxyphenyl)ethylcarbamoyl]cyclopropane-1-carboxylic acid
CID 124674779
N-[2-(2-methoxyphenyl)ethyl]morpholine-2-carboxamide
CID 103808140
N-[2-(2-ethoxyphenyl)ethyl]pyrrolidine-3-carboxamide
CID 119772912
2-N-[2-(2-methoxyphenyl)ethyl]-1-N-phenylcyclopropane-1,2-dicarboxamide
CID 109137821
trans-(1S,2S)-N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]-2-methylcyclopropane-1-carboxamide
CID 94164156
N-[4-[2-(2-methoxyphenyl)ethylamino]-4-oxobutyl]cyclopropanecarboxamide
CID 39930096
2-[2-(2-methoxyphenyl)ethylcarbamoyl]cyclopentane-1-carboxylic acid
CID 106259952
N-[2-(2,5-dimethoxyphenyl)ethyl]pyrrolidine-3-carboxamide
CID 119705639
N-[2-(2-methoxyphenyl)ethyl]piperidine-2-carboxamide
CID 11708711
N-[2-(2-methoxyphenyl)ethyl]-2-methylpiperidine-3-carboxamide
CID 106261503
N-[2-(2-methoxyphenyl)ethyl]-3-methylpiperidine-2-carboxamide
CID 106260939

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide?
The IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide (CID 106261488) is N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide?
The canonical SMILES for N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide is COc1ccccc1CCNC(=O)C1CNCC(C)C1.
What is the InChIKey of N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide?
The InChIKey is ZZGDDYXBTSYKCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12-9-14(11-17-10-12)16(19)18-8-7-13-5-3-4-6-15(13)20-2/h3-6,12,14,17H,7-11H2,1-2H3,(H,18,19).
What are the key properties of N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide?
N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.60, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenyl)ethyl]-5-methylpiperidine-3-carboxamide is sourced from PubChem (CID 106261488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).