2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine

C10H20INO — CID 129095828

IUPAC2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine
SMILESCC(C)CN1CC(C)OC(CI)C1
InChIInChI=1S/C10H20INO/c1-8(2)5-12-6-9(3)13-10(4-11)7-12/h8-10H,4-7H2,1-3H3
InChIKeyQHCHSVUFYZKNFT-UHFFFAOYSA-N
MW297.18 g/mol
LogP2.17
Rot. Bonds3

About 2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine

2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine (PubChem CID 129095828) has the molecular formula C10H20INO and a molecular weight of 297.18 g/mol. Its IUPAC name is 2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine.

Molecular Properties

Compound Name2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine
PubChem CID129095828
Molecular FormulaC10H20INO
Molecular Weight297.18 g/mol
Exact Mass297.06
IUPAC Name2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine
SMILESCC(C)CN1CC(C)OC(CI)C1
InChIInChI=1S/C10H20INO/c1-8(2)5-12-6-9(3)13-10(4-11)7-12/h8-10H,4-7H2,1-3H3
InChIKeyQHCHSVUFYZKNFT-UHFFFAOYSA-N
XLogP2.17
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.18
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(chloromethyl)-6-methyl-4-(3-methylbutyl)morpholine
CID 102936623
2-(chloromethyl)-6-methyl-4-(4-methylpentyl)morpholine
CID 102936587
1,3-bis(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 70522448
(2S)-1-(2,6-dimethylmorpholin-4-yl)-3-methylbutan-2-amine
CID 130522014
3,5-dimethyl-1-(2-methylpropyl)piperidine
CID 20562086
(2S,6S)-1,2,6-trimethyl-4-(2-methylpropyl)piperazine
CID 171515774
ethane;2-methyl-4-(2-methylpropyl)morpholine
CID 156652353
(2S,6R)-4-(2-iodoethyl)-2,6-dimethylmorpholine
CID 131154609
4-[2-(bromomethyl)-3-methylbutyl]-2,6-dimethylmorpholine
CID 65011894
(2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine
CID 104959389
3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methyl-N-propylpropan-1-amine
CID 104960024
3-cyclopropyl-1-(2-methylpropyl)azetidine
CID 126994705

Frequently Asked Questions

What is the IUPAC name of 2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine?
The IUPAC name of 2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine (CID 129095828) is 2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine.
What is the SMILES notation for 2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine?
The canonical SMILES for 2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine is CC(C)CN1CC(C)OC(CI)C1.
What is the InChIKey of 2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine?
The InChIKey is QHCHSVUFYZKNFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20INO/c1-8(2)5-12-6-9(3)13-10(4-11)7-12/h8-10H,4-7H2,1-3H3.
What are the key properties of 2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine?
2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine has a molecular weight of 297.18 g/mol, XLogP of 2.17, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(iodomethyl)-6-methyl-4-(2-methylpropyl)morpholine is sourced from PubChem (CID 129095828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).