ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate

C11H22N2O2 — CID 82734865

IUPACethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate
SMILESCCOC(=O)NCC1NCCCC1CC
InChIInChI=1S/C11H22N2O2/c1-3-9-6-5-7-12-10(9)8-13-11(14)15-4-2/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyOUHMOHWJYDHUSC-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.51
Rot. Bonds4

About ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate

ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate (PubChem CID 82734865) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate.

Molecular Properties

Compound Nameethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate
PubChem CID82734865
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Nameethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate
SMILESCCOC(=O)NCC1NCCCC1CC
InChIInChI=1S/C11H22N2O2/c1-3-9-6-5-7-12-10(9)8-13-11(14)15-4-2/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyOUHMOHWJYDHUSC-UHFFFAOYSA-N
XLogP1.51
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-ethylpiperidin-2-yl)methyl]acetamide
CID 82734521
N-[(3-ethylpiperidin-2-yl)methyl]pentanamide
CID 82735090
N-[(3-ethylpiperidin-2-yl)methyl]-2-methylcyclopentane-1-carboxamide
CID 107176843
1-[(3-ethylpiperidin-2-yl)methyl]-3-(4-methylphenyl)urea
CID 82733939
N-[(3-ethylpiperidin-2-yl)methyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 103206941
2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide
CID 82732420
N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide
CID 82732402
N-[(3-ethylpiperidin-2-yl)methyl]-2-(4-fluorophenyl)acetamide
CID 82734161
ethyl 3-ethylpiperidine-2-carboxylate
CID 144594238
N-[(3-ethylpiperidin-2-yl)methyl]-3-methoxy-4-methylbenzamide
CID 82731476
(2S,3S)-2,3-diethylpiperidine
CID 89278402
2,3-diethylpiperidine;ethane
CID 144800386

Frequently Asked Questions

What is the IUPAC name of ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate?
The IUPAC name of ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate (CID 82734865) is ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate.
What is the SMILES notation for ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate?
The canonical SMILES for ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate is CCOC(=O)NCC1NCCCC1CC.
What is the InChIKey of ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate?
The InChIKey is OUHMOHWJYDHUSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-9-6-5-7-12-10(9)8-13-11(14)15-4-2/h9-10,12H,3-8H2,1-2H3,(H,13,14).
What are the key properties of ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate?
ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate has a molecular weight of 214.31 g/mol, XLogP of 1.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[(3-ethylpiperidin-2-yl)methyl]carbamate is sourced from PubChem (CID 82734865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).