[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate

C17H26N2O2 — CID 11011729

IUPAC[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate
SMILESCN(C)C(=O)Oc1ccccc1CCC1CCCCN1C
InChIInChI=1S/C17H26N2O2/c1-18(2)17(20)21-16-10-5-4-8-14(16)11-12-15-9-6-7-13-19(15)3/h4-5,8,10,15H,6-7,9,11-13H2,1-3H3
InChIKeySJRVREOXCIHIIK-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.16
Rot. Bonds4

About [2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate

[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate (PubChem CID 11011729) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is [2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate.

Molecular Properties

Compound Name[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate
PubChem CID11011729
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate
SMILESCN(C)C(=O)Oc1ccccc1CCC1CCCCN1C
InChIInChI=1S/C17H26N2O2/c1-18(2)17(20)21-16-10-5-4-8-14(16)11-12-15-9-6-7-13-19(15)3/h4-5,8,10,15H,6-7,9,11-13H2,1-3H3
InChIKeySJRVREOXCIHIIK-UHFFFAOYSA-N
XLogP3.16
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(piperidin-1-ylmethyl)phenyl] N,N-dimethylcarbamate
CID 11043577
2-[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl]phenol
CID 153351940
4-chloro-N-[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl]benzamide
CID 20560119
[4-benzamido-3-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] acetate
CID 20560025
2-[2-[2-[2-(2-methoxyphenyl)ethyl]phenoxy]ethyl]-1-methylpyrrolidine
CID 10499737
N-[[2-[2-(1-methylpiperidin-2-yl)ethoxy]phenyl]methyl]ethanamine
CID 107911038
[2-[2-(1-methylpiperidin-2-yl)ethyl]-4-nitrophenyl] hydrogen carbonate;hydrochloride
CID 141393691
2-[4-methyl-2-[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl]phenyl]acetic acid
CID 146175407
N-[[2-(aminomethyl)phenyl]methyl]-N-methyl-2-(1-methylpiperidin-2-yl)ethanamine
CID 107911250
N-[(2-aminophenyl)methyl]-2-[2-(1-methylpiperidin-2-yl)ethyl]aniline
CID 59861095
2-(2-methoxyphenyl)-1-[4-[[(2S)-1-methylpiperidin-2-yl]methyl]piperazin-1-yl]ethanone
CID 95293833
1-[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl]-3-phenylthiourea
CID 13193105

Frequently Asked Questions

What is the IUPAC name of [2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate?
The IUPAC name of [2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate (CID 11011729) is [2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate.
What is the SMILES notation for [2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate?
The canonical SMILES for [2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate is CN(C)C(=O)Oc1ccccc1CCC1CCCCN1C.
What is the InChIKey of [2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate?
The InChIKey is SJRVREOXCIHIIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-18(2)17(20)21-16-10-5-4-8-14(16)11-12-15-9-6-7-13-19(15)3/h4-5,8,10,15H,6-7,9,11-13H2,1-3H3.
What are the key properties of [2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate?
[2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate has a molecular weight of 290.41 g/mol, XLogP of 3.16, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(1-methylpiperidin-2-yl)ethyl]phenyl] N,N-dimethylcarbamate is sourced from PubChem (CID 11011729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).