4-(methoxymethylidene)-1-(tritiomethyl)piperidine

C8H15NO — CID 90207860

IUPAC4-(methoxymethylidene)-1-(tritiomethyl)piperidine
SMILES[3H]CN1CCC(=COC)CC1
InChIInChI=1S/C8H15NO/c1-9-5-3-8(4-6-9)7-10-2/h7H,3-6H2,1-2H3/i1T
InChIKeyCAUCVYRFGFHKGP-CNRUNOGKSA-N
MW143.22 g/mol
LogP1.24
Rot. Bonds2

About 4-(methoxymethylidene)-1-(tritiomethyl)piperidine

4-(methoxymethylidene)-1-(tritiomethyl)piperidine (PubChem CID 90207860) has the molecular formula C8H15NO and a molecular weight of 143.22 g/mol. Its IUPAC name is 4-(methoxymethylidene)-1-(tritiomethyl)piperidine.

Molecular Properties

Compound Name4-(methoxymethylidene)-1-(tritiomethyl)piperidine
PubChem CID90207860
Molecular FormulaC8H15NO
Molecular Weight143.22 g/mol
Exact Mass143.12
IUPAC Name4-(methoxymethylidene)-1-(tritiomethyl)piperidine
SMILES[3H]CN1CCC(=COC)CC1
InChIInChI=1S/C8H15NO/c1-9-5-3-8(4-6-9)7-10-2/h7H,3-6H2,1-2H3/i1T
InChIKeyCAUCVYRFGFHKGP-CNRUNOGKSA-N
XLogP1.24
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.22
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

1-[(2E)-3-fluoro-2-(methoxymethylidene)hex-5-enyl]piperidine
CID 144347245
1-[4-(2-Methylprop-1-enoxy)but-2-ynyl]piperidine
CID 11171791
4-(Methoxymethylidene)piperidine
CID 19859122
(1-Methylpiperidin-4-ylidene)methoxymethanamine
CID 20756951
(1-Methylpiperidin-4-ylidene)methoxymethanol
CID 20756952
(1-Methylpiperidin-4-ylidene)methyl acetate
CID 20756953
(1-methylpiperidin-4-ylidene)methyl N-methylmethanimidate
CID 20756964
1-(2-Methoxyethyl)-4-methylidenepiperidine
CID 21023790
1-Ethyl-3-(methoxymethylidene)piperidine
CID 56636098
(4E)-4-(methoxymethylidene)-1,3-dimethylpiperidine
CID 59049777
1-(3-Methoxypropyl)-3-methylidenepiperidine
CID 59324995
1-Methoxy-4-methoxymethylene-piperidine
CID 68299233

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethylidene)-1-(tritiomethyl)piperidine?
The IUPAC name of 4-(methoxymethylidene)-1-(tritiomethyl)piperidine (CID 90207860) is 4-(methoxymethylidene)-1-(tritiomethyl)piperidine.
What is the SMILES notation for 4-(methoxymethylidene)-1-(tritiomethyl)piperidine?
The canonical SMILES for 4-(methoxymethylidene)-1-(tritiomethyl)piperidine is [3H]CN1CCC(=COC)CC1.
What is the InChIKey of 4-(methoxymethylidene)-1-(tritiomethyl)piperidine?
The InChIKey is CAUCVYRFGFHKGP-CNRUNOGKSA-N. The full InChI is InChI=1S/C8H15NO/c1-9-5-3-8(4-6-9)7-10-2/h7H,3-6H2,1-2H3/i1T.
What are the key properties of 4-(methoxymethylidene)-1-(tritiomethyl)piperidine?
4-(methoxymethylidene)-1-(tritiomethyl)piperidine has a molecular weight of 143.22 g/mol, XLogP of 1.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethylidene)-1-(tritiomethyl)piperidine is sourced from PubChem (CID 90207860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).