N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine

C14H26N2O2 — CID 107912587

IUPACN-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine
SMILESCN1CCCCC1CCOC1CCC(=NO)CC1
InChIInChI=1S/C14H26N2O2/c1-16-10-3-2-4-13(16)9-11-18-14-7-5-12(15-17)6-8-14/h13-14,17H,2-11H2,1H3/b15-12-
InChIKeyXQGIBHHPQVZSTN-QINSGFPZSA-N
MW254.37 g/mol
LogP2.65
Rot. Bonds4

About N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine

N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine (PubChem CID 107912587) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine.

Molecular Properties

Compound NameN-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine
PubChem CID107912587
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine
SMILESCN1CCCCC1CCOC1CCC(=NO)CC1
InChIInChI=1S/C14H26N2O2/c1-16-10-3-2-4-13(16)9-11-18-14-7-5-12(15-17)6-8-14/h13-14,17H,2-11H2,1H3/b15-12-
InChIKeyXQGIBHHPQVZSTN-QINSGFPZSA-N
XLogP2.65
TPSA45.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-cyclopentyloxyethyl)-1-methylpiperidine
CID 23339262
1-methyl-2-[2-[(3S)-piperidin-3-yl]oxyethyl]piperidine
CID 107912978
1-methyl-2-[2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyloxy)ethyl]pyrrolidine
CID 4198010
11-[(2R)-1-methylpyrrolidin-2-yl]undecan-1-ol
CID 11777143
1-methyl-2-(2-phenoxyethyl)piperidine
CID 23339547
1-methyl-2-tetradecylpyrrolidine
CID 24796983
1-methyl-2-(2-pyrrolidin-1-ylethyl)pyrrolidine
CID 59939510
2-[(2S)-1-methylazepan-2-yl]ethanamine;molecular hydrogen
CID 178143502
(2S)-1-methyl-2-[3-[(2-methylpropan-2-yl)oxy]propyl]pyrrolidine
CID 146334915
1-methyl-2-[(1-methylpiperidin-2-yl)methyl]piperidine
CID 54394556
(2R)-2-ethyl-1-methylpiperidine
CID 67552955
2-[2-(4-cyclohexyloxyphenoxy)ethyl]-1-methylpyrrolidine
CID 54248259

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine?
The IUPAC name of N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine (CID 107912587) is N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine.
What is the SMILES notation for N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine?
The canonical SMILES for N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine is CN1CCCCC1CCOC1CCC(=NO)CC1.
What is the InChIKey of N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine?
The InChIKey is XQGIBHHPQVZSTN-QINSGFPZSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-16-10-3-2-4-13(16)9-11-18-14-7-5-12(15-17)6-8-14/h13-14,17H,2-11H2,1H3/b15-12-.
What are the key properties of N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine?
N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine has a molecular weight of 254.37 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(1-methylpiperidin-2-yl)ethoxy]cyclohexylidene]hydroxylamine is sourced from PubChem (CID 107912587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).