N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide

C14H26N2O2 — CID 63826362

IUPACN-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)NCCOC1CCCCC1
InChIInChI=1S/C14H26N2O2/c17-14(11-12-5-4-8-15-12)16-9-10-18-13-6-2-1-3-7-13/h12-13,15H,1-11H2,(H,16,17)
InChIKeyQYBULQFPKZOJPG-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.59
Rot. Bonds6

About N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide

N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide (PubChem CID 63826362) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide
PubChem CID63826362
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)NCCOC1CCCCC1
InChIInChI=1S/C14H26N2O2/c17-14(11-12-5-4-8-15-12)16-9-10-18-13-6-2-1-3-7-13/h12-13,15H,1-11H2,(H,16,17)
InChIKeyQYBULQFPKZOJPG-UHFFFAOYSA-N
XLogP1.59
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-cyclopentyloxyethyl)-2-(1,1-dioxo-1,4-thiazinan-3-yl)acetamide
CID 80520771
N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119725744
N-(cyclopentylmethyl)-2-pyrrolidin-2-ylacetamide
CID 61370022
N-(2-cyclohexylethyl)-2-piperidin-2-ylacetamide
CID 54932758
N-(3-cyclohexyloxypropyl)-2-thiomorpholin-3-ylacetamide;hydrochloride
CID 119935650
2-(2-aminocyclohexyl)-N-(2-cyclohexyloxyethyl)acetamide
CID 63834168
N-octyl-2-pyrrolidin-2-ylacetamide
CID 115567860
N-[3-(2-methylpropoxy)propyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119693624
N-(3-cyclopentyloxypropyl)-2-thiomorpholin-3-ylacetamide;hydrochloride
CID 119938129
N-(2-cyclohexyloxyethyl)-2-(cyclopropylmethylamino)acetamide
CID 63826704
N-(3-aminopropyl)-2-pyrrolidin-2-ylacetamide
CID 61366460
(2R)-N-(2-cyclohexyloxyethyl)piperidine-2-carboxamide;hydrochloride
CID 119746139

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide (CID 63826362) is N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide is O=C(CC1CCCN1)NCCOC1CCCCC1.
What is the InChIKey of N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide?
The InChIKey is QYBULQFPKZOJPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c17-14(11-12-5-4-8-15-12)16-9-10-18-13-6-2-1-3-7-13/h12-13,15H,1-11H2,(H,16,17).
What are the key properties of N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide?
N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide has a molecular weight of 254.37 g/mol, XLogP of 1.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 63826362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).