(2R)-4-iodo-1,2-dimethylpiperidine

C7H14IN — CID 177325469

IUPAC(2R)-4-iodo-1,2-dimethylpiperidine
SMILESC[C@@H]1CC(I)CCN1C
InChIInChI=1S/C7H14IN/c1-6-5-7(8)3-4-9(6)2/h6-7H,3-5H2,1-2H3/t6-,7?/m1/s1
InChIKeyTYAKPATXGZHZAJ-ULUSZKPHSA-N
MW239.10 g/mol
LogP1.90
Rot. Bonds

About (2R)-4-iodo-1,2-dimethylpiperidine

(2R)-4-iodo-1,2-dimethylpiperidine (PubChem CID 177325469) has the molecular formula C7H14IN and a molecular weight of 239.10 g/mol. Its IUPAC name is (2R)-4-iodo-1,2-dimethylpiperidine.

Molecular Properties

Compound Name(2R)-4-iodo-1,2-dimethylpiperidine
PubChem CID177325469
Molecular FormulaC7H14IN
Molecular Weight239.10 g/mol
Exact Mass239.02
IUPAC Name(2R)-4-iodo-1,2-dimethylpiperidine
SMILESC[C@@H]1CC(I)CCN1C
InChIInChI=1S/C7H14IN/c1-6-5-7(8)3-4-9(6)2/h6-7H,3-5H2,1-2H3/t6-,7?/m1/s1
InChIKeyTYAKPATXGZHZAJ-ULUSZKPHSA-N
XLogP1.90
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.10
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,4-diiodo-2-methylpiperidine
CID 170289869
(2R,4S)-N,1,2-trimethylpiperidin-4-amine
CID 94244018
(2R)-4-cyclobutyl-1,2-dimethylpiperidine
CID 171414314
(2S,4R)-N,1,2-trimethylpiperidin-4-amine
CID 94244017
ethane;N,1,2-trimethylpiperidin-4-amine
CID 178011529
2-iodo-1-methylazetidine
CID 90368179
(2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine
CID 171414290
(1,2-dimethylpiperidin-4-yl)hydrazine
CID 55281806
[(2S,4S)-1,2-dimethylpiperidin-4-yl]hydrazine;hydrochloride
CID 170897700
2-(1,2-dimethylpiperidin-4-yl)-1,1-dimethylhydrazine
CID 83005430
1-[(2S,4S)-1,2-dimethylpiperidin-4-yl]piperazine
CID 95913076
1,2-dimethyl-N-(1-methyltetrazol-5-yl)piperidin-4-amine
CID 79034136

Frequently Asked Questions

What is the IUPAC name of (2R)-4-iodo-1,2-dimethylpiperidine?
The IUPAC name of (2R)-4-iodo-1,2-dimethylpiperidine (CID 177325469) is (2R)-4-iodo-1,2-dimethylpiperidine.
What is the SMILES notation for (2R)-4-iodo-1,2-dimethylpiperidine?
The canonical SMILES for (2R)-4-iodo-1,2-dimethylpiperidine is C[C@@H]1CC(I)CCN1C.
What is the InChIKey of (2R)-4-iodo-1,2-dimethylpiperidine?
The InChIKey is TYAKPATXGZHZAJ-ULUSZKPHSA-N. The full InChI is InChI=1S/C7H14IN/c1-6-5-7(8)3-4-9(6)2/h6-7H,3-5H2,1-2H3/t6-,7?/m1/s1.
What are the key properties of (2R)-4-iodo-1,2-dimethylpiperidine?
(2R)-4-iodo-1,2-dimethylpiperidine has a molecular weight of 239.10 g/mol, XLogP of 1.90, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-iodo-1,2-dimethylpiperidine is sourced from PubChem (CID 177325469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).