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

C17H26N2O2 — CID 63131997

IUPAC3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide
SMILESCCC1(C(=O)N(C)Cc2ccccc2OC)CCCNC1
InChIInChI=1S/C17H26N2O2/c1-4-17(10-7-11-18-13-17)16(20)19(2)12-14-8-5-6-9-15(14)21-3/h5-6,8-9,18H,4,7,10-13H2,1-3H3
InChIKeyCINMNVTXHCUUFY-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.43
Rot. Bonds5

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

3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide (PubChem CID 63131997) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide
PubChem CID63131997
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide
SMILESCCC1(C(=O)N(C)Cc2ccccc2OC)CCCNC1
InChIInChI=1S/C17H26N2O2/c1-4-17(10-7-11-18-13-17)16(20)19(2)12-14-8-5-6-9-15(14)21-3/h5-6,8-9,18H,4,7,10-13H2,1-3H3
InChIKeyCINMNVTXHCUUFY-UHFFFAOYSA-N
XLogP2.43
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-4-carboxamide
CID 63128870
N-[(2-ethoxyphenyl)methyl]-N,3-dimethylpiperidine-3-carboxamide
CID 63131473
N-[(4-bromophenyl)methyl]-3-ethyl-N-methylpiperidine-3-carboxamide
CID 63130855
1-[(2-methoxyphenyl)methyl-methylcarbamoyl]cyclobutane-1-carboxylic acid
CID 62095246
3-ethyl-N-methyl-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 63130194
1-(aminomethyl)-N-[(2-ethoxyphenyl)methyl]-N-methylcyclopentane-1-carboxamide
CID 81487244
N-[(2-hydroxyphenyl)methyl]-N-methyl-3-propylpyrrolidine-3-carboxamide
CID 63143991
3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide
CID 63131049
(3S)-N-[(2-ethoxyphenyl)methyl]-3-fluoro-N-methylpyrrolidine-3-carboxamide
CID 124588666
N-methyl-3-propyl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 63130322
N-[(2,3-dimethoxyphenyl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 63140447
N-[1-(2-chlorophenyl)ethyl]-3-ethyl-N-methylpiperidine-3-carboxamide
CID 63130733

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide (CID 63131997) is 3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide is CCC1(C(=O)N(C)Cc2ccccc2OC)CCCNC1.
What is the InChIKey of 3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide?
The InChIKey is CINMNVTXHCUUFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-4-17(10-7-11-18-13-17)16(20)19(2)12-14-8-5-6-9-15(14)21-3/h5-6,8-9,18H,4,7,10-13H2,1-3H3.
What are the key properties of 3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide?
3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 63131997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).