methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate

C13H24N2O3 — CID 112543373

IUPACmethyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate
SMILESCOC(=O)NC1CC(CCO)CN(C2CCC2)C1
InChIInChI=1S/C13H24N2O3/c1-18-13(17)14-11-7-10(5-6-16)8-15(9-11)12-3-2-4-12/h10-12,16H,2-9H2,1H3,(H,14,17)
InChIKeyIFBIJESXBZOICB-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.97
Rot. Bonds4

About methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate

methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate (PubChem CID 112543373) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate.

Molecular Properties

Compound Namemethyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate
PubChem CID112543373
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Namemethyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate
SMILESCOC(=O)NC1CC(CCO)CN(C2CCC2)C1
InChIInChI=1S/C13H24N2O3/c1-18-13(17)14-11-7-10(5-6-16)8-15(9-11)12-3-2-4-12/h10-12,16H,2-9H2,1H3,(H,14,17)
InChIKeyIFBIJESXBZOICB-UHFFFAOYSA-N
XLogP0.97
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate 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 N-[1-cyclopentyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate
CID 112543328
N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]-2-methylpropanamide
CID 112542837
methyl N-(5-butyl-1-cyclopropylpiperidin-3-yl)carbamate
CID 112543336
2-[1-cyclopentyl-5-(methylamino)piperidin-3-yl]ethanol
CID 83989863
ethyl N-(1-cyclopentyl-5-propylpiperidin-3-yl)carbamate
CID 112543963
2-[1-cyclobutyl-5-(cyclobutylmethylamino)piperidin-3-yl]ethanol
CID 83997337
ethyl N-(5-butyl-1-cyclopentylpiperidin-3-yl)carbamate
CID 112543964
methyl N-[1-butyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate
CID 112543097
methyl 1-cyclobutyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]piperidine-3-carboxylate
CID 112544651
3-[1-cyclobutyl-5-(cyclopropylamino)piperidin-3-yl]propan-1-ol
CID 83991811
3-[1-cyclobutyl-5-(cyclopropylmethylamino)piperidin-3-yl]propan-1-ol
CID 83996650
methyl N-(1-cyclohexylpyrrolidin-3-yl)carbamate
CID 110477693

Frequently Asked Questions

What is the IUPAC name of methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate?
The IUPAC name of methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate (CID 112543373) is methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate.
What is the SMILES notation for methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate?
The canonical SMILES for methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate is COC(=O)NC1CC(CCO)CN(C2CCC2)C1.
What is the InChIKey of methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate?
The InChIKey is IFBIJESXBZOICB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-18-13(17)14-11-7-10(5-6-16)8-15(9-11)12-3-2-4-12/h10-12,16H,2-9H2,1H3,(H,14,17).
What are the key properties of methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate?
methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate has a molecular weight of 256.35 g/mol, XLogP of 0.97, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[1-cyclobutyl-5-(2-hydroxyethyl)piperidin-3-yl]carbamate is sourced from PubChem (CID 112543373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).