2-methoxyethyl N-piperidin-4-ylcarbamate

C9H18N2O3 — CID 15676970

IUPAC2-methoxyethyl N-piperidin-4-ylcarbamate
SMILESCOCCOC(=O)NC1CCNCC1
InChIInChI=1S/C9H18N2O3/c1-13-6-7-14-9(12)11-8-2-4-10-5-3-8/h8,10H,2-7H2,1H3,(H,11,12)
InChIKeySFBZFUAUXKERGN-UHFFFAOYSA-N
MW202.25 g/mol
LogP0.11
Rot. Bonds4

About 2-methoxyethyl N-piperidin-4-ylcarbamate

2-methoxyethyl N-piperidin-4-ylcarbamate (PubChem CID 15676970) has the molecular formula C9H18N2O3 and a molecular weight of 202.25 g/mol. Its IUPAC name is 2-methoxyethyl N-piperidin-4-ylcarbamate.

Molecular Properties

Compound Name2-methoxyethyl N-piperidin-4-ylcarbamate
PubChem CID15676970
Molecular FormulaC9H18N2O3
Molecular Weight202.25 g/mol
Exact Mass202.13
IUPAC Name2-methoxyethyl N-piperidin-4-ylcarbamate
SMILESCOCCOC(=O)NC1CCNCC1
InChIInChI=1S/C9H18N2O3/c1-13-6-7-14-9(12)11-8-2-4-10-5-3-8/h8,10H,2-7H2,1H3,(H,11,12)
InChIKeySFBZFUAUXKERGN-UHFFFAOYSA-N
XLogP0.11
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(diethylamino)ethyl N-piperidin-4-ylcarbamate
CID 15676972
2-methoxyethyl N-(piperidin-4-ylmethyl)carbamate
CID 145158678
ethyl N-pyrrolidin-3-ylcarbamate
CID 11321104
ethyl N-[(3R)-pyrrolidin-3-yl]carbamate;hydrochloride
CID 118918439
N-(azepan-4-yl)-2-(2-methoxyethoxy)acetamide
CID 105061038
1-(2-methoxyethyl)-N-piperidin-4-ylcyclobutane-1-carboxamide;hydrochloride
CID 119389324
2,2-dimethylpropyl N-pyrrolidin-3-ylcarbamate
CID 142337471
2-methylbutan-2-yl N-piperidin-4-ylcarbamate
CID 67158317
9H-fluoren-9-ylmethyl N-piperidin-4-ylcarbamate
CID 2756219
2-aminoethyl N-cyclohexylcarbamate;molecular hydrogen
CID 159671742
4-O-(2-methoxyethyl) 1-O-(2-piperazin-1-ylethyl) cyclohexane-1,4-dicarboxylate
CID 164933248
N-(2-methoxyethylsulfamoyl)piperidin-4-amine
CID 114814237

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethyl N-piperidin-4-ylcarbamate?
The IUPAC name of 2-methoxyethyl N-piperidin-4-ylcarbamate (CID 15676970) is 2-methoxyethyl N-piperidin-4-ylcarbamate.
What is the SMILES notation for 2-methoxyethyl N-piperidin-4-ylcarbamate?
The canonical SMILES for 2-methoxyethyl N-piperidin-4-ylcarbamate is COCCOC(=O)NC1CCNCC1.
What is the InChIKey of 2-methoxyethyl N-piperidin-4-ylcarbamate?
The InChIKey is SFBZFUAUXKERGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3/c1-13-6-7-14-9(12)11-8-2-4-10-5-3-8/h8,10H,2-7H2,1H3,(H,11,12).
What are the key properties of 2-methoxyethyl N-piperidin-4-ylcarbamate?
2-methoxyethyl N-piperidin-4-ylcarbamate has a molecular weight of 202.25 g/mol, XLogP of 0.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethyl N-piperidin-4-ylcarbamate is sourced from PubChem (CID 15676970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).