(2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide

C10H20N2O2 — CID 41256086

IUPAC(2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide
SMILESCOCCNC(=O)N1CCCC[C@@H]1C
InChIInChI=1S/C10H20N2O2/c1-9-5-3-4-7-12(9)10(13)11-6-8-14-2/h9H,3-8H2,1-2H3,(H,11,13)/t9-/m0/s1
InChIKeyKEKONLBIASUBDJ-VIFPVBQESA-N
MW200.28 g/mol
LogP1.22
Rot. Bonds3

About (2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide

(2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide (PubChem CID 41256086) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is (2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide.

Molecular Properties

Compound Name(2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide
PubChem CID41256086
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name(2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide
SMILESCOCCNC(=O)N1CCCC[C@@H]1C
InChIInChI=1S/C10H20N2O2/c1-9-5-3-4-7-12(9)10(13)11-6-8-14-2/h9H,3-8H2,1-2H3,(H,11,13)/t9-/m0/s1
InChIKeyKEKONLBIASUBDJ-VIFPVBQESA-N
XLogP1.22
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide?
The IUPAC name of (2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide (CID 41256086) is (2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide.
What is the SMILES notation for (2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide?
The canonical SMILES for (2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide is COCCNC(=O)N1CCCC[C@@H]1C.
What is the InChIKey of (2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide?
The InChIKey is KEKONLBIASUBDJ-VIFPVBQESA-N. The full InChI is InChI=1S/C10H20N2O2/c1-9-5-3-4-7-12(9)10(13)11-6-8-14-2/h9H,3-8H2,1-2H3,(H,11,13)/t9-/m0/s1.
What are the key properties of (2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide?
(2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-methoxyethyl)-2-methylpiperidine-1-carboxamide is sourced from PubChem (CID 41256086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).