methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate

C9H16N2O4 — CID 90067056

IUPACmethyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate
SMILESCNC(=O)N1CCC(O)(C(=O)OC)CC1
InChIInChI=1S/C9H16N2O4/c1-10-8(13)11-5-3-9(14,4-6-11)7(12)15-2/h14H,3-6H2,1-2H3,(H,10,13)
InChIKeyIAKVDPRBALXXRG-UHFFFAOYSA-N
MW216.24 g/mol
LogP-0.67
Rot. Bonds1

About methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate

methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate (PubChem CID 90067056) has the molecular formula C9H16N2O4 and a molecular weight of 216.24 g/mol. Its IUPAC name is methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate.

Molecular Properties

Compound Namemethyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate
PubChem CID90067056
Molecular FormulaC9H16N2O4
Molecular Weight216.24 g/mol
Exact Mass216.11
IUPAC Namemethyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate
SMILESCNC(=O)N1CCC(O)(C(=O)OC)CC1
InChIInChI=1S/C9H16N2O4/c1-10-8(13)11-5-3-9(14,4-6-11)7(12)15-2/h14H,3-6H2,1-2H3,(H,10,13)
InChIKeyIAKVDPRBALXXRG-UHFFFAOYSA-N
XLogP-0.67
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-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 1-hydroxycyclopropane-1-carboxylate
CID 2733178
methyl 1-[(2,4-dimethyl-1,3-thiazol-5-yl)carbamoyl]-4-hydroxypiperidine-4-carboxylate
CID 167959574
[4-methyl-1-(methylcarbamoyl)piperidin-4-yl] carbamate
CID 175278143
2-(2-methoxyprop-2-enoyl)-N-methyl-2,7-diazaspiro[3.5]nonane-7-carboxamide
CID 170011341
N-methyl-3,9-diazaspiro[5.5]undecane-3-carboxamide
CID 155067147
methyl 4-hydroxythiane-4-carboxylate
CID 62214662
methyl 1-acetyl-4-cyanopiperidine-4-carboxylate
CID 23447453
3,3-diethyl-N-methylpyrrolidine-1-carboxamide
CID 115686572
3-hydroxy-N,3-dimethylpiperidine-1-carboxamide
CID 115872031
N-methyl-2-[2-(methylamino)acetyl]-2,7-diazaspiro[3.5]nonane-7-carboxamide
CID 146624355
N,4,4-trimethylpiperazin-4-ium-1-carboxamide
CID 20728475
methyl 1-[(2R)-2-[(4-tert-butylbenzoyl)amino]-3-methylbutanoyl]-4-hydroxypiperidine-4-carboxylate
CID 97254272

Frequently Asked Questions

What is the IUPAC name of methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate?
The IUPAC name of methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate (CID 90067056) is methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate.
What is the SMILES notation for methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate?
The canonical SMILES for methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate is CNC(=O)N1CCC(O)(C(=O)OC)CC1.
What is the InChIKey of methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate?
The InChIKey is IAKVDPRBALXXRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O4/c1-10-8(13)11-5-3-9(14,4-6-11)7(12)15-2/h14H,3-6H2,1-2H3,(H,10,13).
What are the key properties of methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate?
methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate has a molecular weight of 216.24 g/mol, XLogP of -0.67, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-hydroxy-1-(methylcarbamoyl)piperidine-4-carboxylate is sourced from PubChem (CID 90067056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).