methyl 2-ethyl-5-methylpiperidine-3-carboxylate

C10H19NO2 — CID 83915219

IUPACmethyl 2-ethyl-5-methylpiperidine-3-carboxylate
SMILESCCC1NCC(C)CC1C(=O)OC
InChIInChI=1S/C10H19NO2/c1-4-9-8(10(12)13-3)5-7(2)6-11-9/h7-9,11H,4-6H2,1-3H3
InChIKeyJJFVJJSWJGGSMN-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.18
Rot. Bonds2

About methyl 2-ethyl-5-methylpiperidine-3-carboxylate

methyl 2-ethyl-5-methylpiperidine-3-carboxylate (PubChem CID 83915219) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is methyl 2-ethyl-5-methylpiperidine-3-carboxylate.

Molecular Properties

Compound Namemethyl 2-ethyl-5-methylpiperidine-3-carboxylate
PubChem CID83915219
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Namemethyl 2-ethyl-5-methylpiperidine-3-carboxylate
SMILESCCC1NCC(C)CC1C(=O)OC
InChIInChI=1S/C10H19NO2/c1-4-9-8(10(12)13-3)5-7(2)6-11-9/h7-9,11H,4-6H2,1-3H3
InChIKeyJJFVJJSWJGGSMN-UHFFFAOYSA-N
XLogP1.18
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze methyl 2-ethyl-5-methylpiperidine-3-carboxylate 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

methyl 2-ethyl-3-methylpiperidine-4-carboxylate
CID 83915229
tetramethyl (1S,2R,4S,5R)-cyclohexane-1,2,4,5-tetracarboxylate
CID 102016488
dimethyl cyclopropane-1,2-dicarboxylate
CID 2724542
methyl (3R)-5-methylpiperidine-3-carboxylate
CID 178133263
methyl 2-methylazetidine-3-carboxylate;hydrochloride
CID 118796246
2-methoxycarbonyl-4-methylcyclohexane-1-carboxylic acid
CID 58841229
methyl 5-methylpiperidine-3-carboxylate;hydrochloride
CID 75464874
5-cyclopropyl-2-ethylpiperidine-3-carboxylic acid
CID 83915874
methyl (2S,3R,5S)-2-(3,4-dimethoxyphenyl)-5-methylpiperidine-3-carboxylate
CID 10957323
methyl (3R,4S)-4-methylpyrrolidine-3-carboxylate;hydrochloride
CID 131632354
dimethyl 4-ethylcyclohexane-1,2-dicarboxylate
CID 123726982
methyl 5-(fluoromethyl)pyrrolidine-3-carboxylate
CID 67033610

Frequently Asked Questions

What is the IUPAC name of methyl 2-ethyl-5-methylpiperidine-3-carboxylate?
The IUPAC name of methyl 2-ethyl-5-methylpiperidine-3-carboxylate (CID 83915219) is methyl 2-ethyl-5-methylpiperidine-3-carboxylate.
What is the SMILES notation for methyl 2-ethyl-5-methylpiperidine-3-carboxylate?
The canonical SMILES for methyl 2-ethyl-5-methylpiperidine-3-carboxylate is CCC1NCC(C)CC1C(=O)OC.
What is the InChIKey of methyl 2-ethyl-5-methylpiperidine-3-carboxylate?
The InChIKey is JJFVJJSWJGGSMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-4-9-8(10(12)13-3)5-7(2)6-11-9/h7-9,11H,4-6H2,1-3H3.
What are the key properties of methyl 2-ethyl-5-methylpiperidine-3-carboxylate?
methyl 2-ethyl-5-methylpiperidine-3-carboxylate has a molecular weight of 185.27 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-ethyl-5-methylpiperidine-3-carboxylate is sourced from PubChem (CID 83915219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).